Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용

HCID 8992생성일: 2026년 11월 4일

플루메티아지드

플루메티아지드 · Ademol · Routrax · Fludemil · NSC44626 · NSC-44626 · NSC 44626 · flumethiazide

식별자 및 물리적 특성

CAS No.	148-56-1
분자식	C8H6F3N3O4S2
평균 분자량	329.3 g/mol
단동위원소 질량	328.97518251 g/mol
SMILES	NS(=O)(=O)c1cc2c(cc1C(F)(F)F)NC=NS2(=O)=O
InChIKey	RGUQWGXAYZNLMI-UHFFFAOYSA-N
PubChem CID	8992
ChEMBL	CHEMBL2105128
ChEBI	CHEBI:135404
EC No.	205-717-4
DTXSID	DTXSID60163862
현지명	플루메티아지드

화학 및 물리적 성질

XLogP	-0.2
극성 표면적	135
수소 결합 공여자 수	2
수소 결합 수용자 수	9
회전 가능 결합 수	1
무거운 원자 수	20
형식 전하	0
복잡도	617
LogP(분배 계수)	0.32
Color/Form	CRYSTALS
용해도	SPARINGLY SOL IN WATER50 MG/ML IN BOILING WATER WITH DECOMPPRACTICALLY INSOL IN ETHYL ACETATE, METHYL ETHYL KETONE, BENZENE, TOLUENESOL IN METHANOL, ETHANOL, DIMETHYL FORMAMIDE
Other Experimental Properties	UNSTABLE IN ALKALINE SOLN, CONVERSION TO PRECURSOR ALPHA,ALPHA,ALPHA-TRIFLUORO-3-AMINO-4,6-DISULFAMOYLTOLUENEDECOMP @ 305.4-307.8 °C
녹는점	306.6°C
끓는 점	560.0±60.0 °C(Predicted)
밀도	1.6578 (estimate)
pKa(산도 계수)	pKa 6.3(H2O) (Uncertain)
용해도	1.05g/L(상온)

안전 및 규제

상호 작용	TUBULAR TRANSPORT OF THIAZIDES MAY BE INHIBITED BY PROBENECID. /BENZOTHIADIAZIDES/USE OF ENTERIC-COATED COMBINATIONS OF POTASSIUM CHLORIDE & THIAZIDE HAS BEEN ASSOC WITH HIGH INCIDENCE OF ULCERATION OF DISTAL JEJUNUM OR ILEUM. IT IS PREFERABLE TO PRESCRIBE PALATABLE SOLN OF POTASSIUM CHLORIDE... /BENZOTHIADIAZIDES/...THIAZIDE DIURETICS HAVE BEEN PRESCRIBED IN COMBINATION WITH ALDOSTERONE ANTAGONIST OR OTHER POTASSIUM-SPARING DIURETIC IN ORDER TO OBTAIN ADDITIVE DIURETIC EFFECT WITH MAINTENANCE OF POTASSIUM BALANCE. /BENZOTHIADIAZIDES/
Human Toxicity Excerpts	CLINICAL TOXICITY IS RELATIVELY RARE & USUALLY RESULTS FROM UNEXPECTED HYPERSENSITIVITY. CASES HAVE BEEN REPORTED WITH PURPURA, DERMATITIS WITH PHOTOSENSITIVITY, DEPRESSION OF FORMED ELEMENTS OF BLOOD, & NECROTIZING VASCULITIS... /BENZOTHIADIAZIDES/PLASMA URIC ACID IS FREQUENTLY ELEVATED & IN SUSCEPTIBLE PT MAY BE ASSOCIATED WITH ATTACKS OF GOUT. ... MANY OBSERVERS HAVE NOTED CORRELATION WITH HYPOKALEMIA & ALKALOSIS. INCR CONCN OF BLOOD AMMONIA HAVE BEEN REPORTED. /BENZOTHIADIAZIDES/IN PT...WITH HYPERTENSIVE DISEASE & DECR RENAL RESERVE, MANIFESTATIONS OF RENAL INSUFFICIENCY MAY BE AGGRAVATED AFTER INTENSIVE OR PROLONGED COURSES OF THIAZIDES THAT LEAD TO EXCESSIVE DEPLETION OF FLUID & ELECTROLYTE. /BENZOTHIADIAZIDES/IN CIRRHOSIS OF LIVER, DETERIORATIONG OF MENTAL FUNCTION, INCL ONSET OF COMA, HAS BEEN ATTRIBUTED TO THIAZIDE THERAPY. ... CHOLESTATIC HEPATITIS HAS ALSO BEEN REPORTED. THIAZIDES MAY INDUCE HYPERGLYCEMIA & AGGRAVATE PREEXISTING DIABETES MELLITUS. /BENZOTHIADIAZIDES/
유해 물질 데이터	148-56-1(Hazardous Substances Data)

식별자 및 물리적 특성

CAS No.

148-56-1

분자식

C8H6F3N3O4S2

평균 분자량

329.3 g/mol

단동위원소 질량

328.97518251 g/mol

SMILES

NS(=O)(=O)c1cc2c(cc1C(F)(F)F)NC=NS2(=O)=O

InChIKey

RGUQWGXAYZNLMI-UHFFFAOYSA-N

PubChem CID

8992

ChEMBL

CHEMBL2105128

ChEBI

CHEBI:135404

EC No.

205-717-4

DTXSID

DTXSID60163862

현지명

플루메티아지드

화학 및 물리적 성질

XLogP

-0.2

극성 표면적

135

수소 결합 공여자 수

수소 결합 수용자 수

회전 가능 결합 수

무거운 원자 수

형식 전하

복잡도

617

LogP(분배 계수)

0.32

Color/Form

CRYSTALS

용해도

SPARINGLY SOL IN WATER50 MG/ML IN BOILING WATER WITH DECOMPPRACTICALLY INSOL IN ETHYL ACETATE, METHYL ETHYL KETONE, BENZENE, TOLUENESOL IN METHANOL, ETHANOL, DIMETHYL FORMAMIDE

Other Experimental Properties

UNSTABLE IN ALKALINE SOLN, CONVERSION TO PRECURSOR ALPHA,ALPHA,ALPHA-TRIFLUORO-3-AMINO-4,6-DISULFAMOYLTOLUENEDECOMP @ 305.4-307.8 °C

녹는점

306.6°C

끓는 점

560.0±60.0 °C(Predicted)

밀도

1.6578 (estimate)

pKa(산도 계수)

pKa 6.3(H2O) (Uncertain)

용해도

1.05g/L(상온)

안전 및 규제

상호 작용

TUBULAR TRANSPORT OF THIAZIDES MAY BE INHIBITED BY PROBENECID. /BENZOTHIADIAZIDES/USE OF ENTERIC-COATED COMBINATIONS OF POTASSIUM CHLORIDE & THIAZIDE HAS BEEN ASSOC WITH HIGH INCIDENCE OF ULCERATION OF DISTAL JEJUNUM OR ILEUM. IT IS PREFERABLE TO PRESCRIBE PALATABLE SOLN OF POTASSIUM CHLORIDE... /BENZOTHIADIAZIDES/...THIAZIDE DIURETICS HAVE BEEN PRESCRIBED IN COMBINATION WITH ALDOSTERONE ANTAGONIST OR OTHER POTASSIUM-SPARING DIURETIC IN ORDER TO OBTAIN ADDITIVE DIURETIC EFFECT WITH MAINTENANCE OF POTASSIUM BALANCE. /BENZOTHIADIAZIDES/

Human Toxicity Excerpts

CLINICAL TOXICITY IS RELATIVELY RARE & USUALLY RESULTS FROM UNEXPECTED HYPERSENSITIVITY. CASES HAVE BEEN REPORTED WITH PURPURA, DERMATITIS WITH PHOTOSENSITIVITY, DEPRESSION OF FORMED ELEMENTS OF BLOOD, & NECROTIZING VASCULITIS... /BENZOTHIADIAZIDES/PLASMA URIC ACID IS FREQUENTLY ELEVATED & IN SUSCEPTIBLE PT MAY BE ASSOCIATED WITH ATTACKS OF GOUT. ... MANY OBSERVERS HAVE NOTED CORRELATION WITH HYPOKALEMIA & ALKALOSIS. INCR CONCN OF BLOOD AMMONIA HAVE BEEN REPORTED. /BENZOTHIADIAZIDES/IN PT...WITH HYPERTENSIVE DISEASE & DECR RENAL RESERVE, MANIFESTATIONS OF RENAL INSUFFICIENCY MAY BE AGGRAVATED AFTER INTENSIVE OR PROLONGED COURSES OF THIAZIDES THAT LEAD TO EXCESSIVE DEPLETION OF FLUID & ELECTROLYTE. /BENZOTHIADIAZIDES/IN CIRRHOSIS OF LIVER, DETERIORATIONG OF MENTAL FUNCTION, INCL ONSET OF COMA, HAS BEEN ATTRIBUTED TO THIAZIDE THERAPY. ... CHOLESTATIC HEPATITIS HAS ALSO BEEN REPORTED. THIAZIDES MAY INDUCE HYPERGLYCEMIA & AGGRAVATE PREEXISTING DIABETES MELLITUS. /BENZOTHIADIAZIDES/

유해 물질 데이터

148-56-1(Hazardous Substances Data)