4-(아미노메틸)벤젠술폰아미드

Mafenide

HCID 3998CAS 138-39-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: NCc1ccc(S(N)(=O)=O)cc1
InChIKey: TYMRLRRVMHJFTF-UHFFFAOYSA-N
분자식: C7H10N2O2S
평균 분자량: 186.23 g/mol
단동위원소 질량: 186.04629856

개요

Mafenide is an aromatic amine.

이름 및 식별자

우선 이름: Mafenide
IUPAC: 4-(aminomethyl)benzenesulfonamide
현지명: 4-(아미노메틸)벤젠술폰아미드
영어명: 4-(Aminomethyl)benzenesulfonamide
분자식: C7H10N2O2S
분자량: 186.23

이름 및 동의어

mafenide138-39-64-(Aminomethyl)benzenesulfonamideSulfamylonAmbamideBenzenesulfonamide, 4-(aminomethyl)-HomosulfanilamideMaphenidSepticidMafenidaBensulfamideMafenidum

이름 더 보기

4-(아미노메틸)벤젠술폰아미드MaphenideHomosulfamineMesudinHomosulHomonalEmileneMalfaminMesudrin

p-(Aminomethyl)benzenesulfonamideNSC-34632alpha-Amino-p-toluenesulfonamideD06BA0358447S8P4LDTXSID6047860Sulfabenzamine4 Homosulfanilamide

데이터베이스 식별자

CAS: 138-39-6
PubChem CID: 3998
DTXSID: DTXSID6047860
ChEMBL: CHEMBL419
ChEBI: CHEBI:6633
UNII: 58447S8P4L
EC Number: 205-326-9
Nikkaji: J812E

물성

구조 계산 물성

XLogP: -0.7
극성 표면적: 94.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 224

실험 및 물리화학적 성질

Drugs · 2건

Pharmaceuticals -> Antibiotics

Pharmaceuticals -> Listed in ZINC15

Collision Cross Section128.04 Å² [M+H-H2O]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

녹는점: 177 · 177-178℃ (decomposition)
끓는 점: 382 · 382.0±44.0 °C(Predicted)
밀도: 1.345 · 1.345±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 10.16 · 10.16±0.10(Predicted)
색상: 라이트 베이지부터 베이지까지

안전 및 규제

안전 데이터

위험 등급: IRRITANT

화학 및 산업

약리 정보

ATC Code · 2건

D - Dermatologicals

QD - Dermatologicals

Mechanism of ActionThe precise mechanism of mafenide is unknown. However, mafenide reduces the bacterial population in the avascular burn tissue and promotes spontaneous heeling of deep burns.

Metabolism/MetabolitesMetabolized to a carbonic anhydrase inhibitor.

FDA Pharmacological Classification · 5건

58447S8P4L

MAFENIDE

Established Pharmacologic Class [EPC] - Methylated Sulfonamide Antibacterial

Methylated Sulfonamides [EXT]

Mafenide is a Methylated Sulfonamide Antibacterial.

MeSH Pharmacological Classification · 3건

Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.

A class of compounds that reduces the secretion of H+ ions by the proximal kidney tubule through inhibition of CARBONIC ANHYDRASES.

Substances that inhibit the growth or reproduction of BACTERIA.

Absorption, Distribution and Excretion · 2건

Mafenide is absorbed through devascularized areas into the systemic circulation following topical administration.

Renal—Metabolite rapidly excreted in urine in high concentrations; however, the parent compound has not been detected in urine.