2-(2-Furanyl)-7-(2-phenylethyl)-7H-pyrazolo(4,3-e)(1,2,4)triazolo(1,5-c)pyrimidin-5-amine

HCID 176408CAS 160098-96-4
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Nc1nc2c(cnn2CCc2ccccc2)c2nc(-c3ccco3)nn12
InChIKey
UTLPKQYUXOEJIL-UHFFFAOYSA-N
분자식
C18H15N7O
평균 분자량
345.4 g/mol
단동위원소 질량
345.1338081

개요

LSM-3822 is a member of triazolopyrimidines.

이름 및 식별자

우선 이름
2-(2-Furanyl)-7-(2-phenylethyl)-7H-pyrazolo(4,3-e)(1,2,4)triazolo(1,5-c)pyrimidin-5-amine
IUPAC
4-(furan-2-yl)-10-(2-phenylethyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
영어명
SCH 58261
분자식
C18H15N7O
분자량
345.36

이름 및 동의어

Sch 58261160098-96-4Sch582614309023MAHDTXSID801667992-(2-Furanyl)-7-(2-phenylethyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine5-Amino-7-(2-phenylethyl)-2-(2-furyl)-pyrazolo(4,3-e)-1,2,4-triazolo(1,5-c)pyrimidine4-(furan-2-yl)-10-(2-phenylethyl)-3,5,6,8,10,11-hexaazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2,4,7,11-pentaen-7-amine2-(2-Furanyl)-7-(2-phenylethyl)-7H-pyrazolo(4,3-e)(1,2,4)triazolo(1,5-c)pyrimidin-5-amine4-(furan-2-yl)-10-(2-phenylethyl)-3,5,6,8,10,11-hexaazatricyclo(7.3.0.0^(2,6))dodeca-1(9),2,4,7,11-pentaen-7-amineRefChem:884671DTXCID8089290
이름 더 보기
CS-2187SCH58261 ，S8104SCH 58261, 10 mM in DMSOSCH-58261, A2A antagonistButanoicacid,4-bromo-5-oxo-,ethylesterInhibitor,inhibit,SCH-58261,Adenosine Receptor,SCH 58261,P1 receptor2-(Furan-2-yl)-7-(2-phenylethyl)-7H-pyrazolo[4,3-e][1,2,4]-triazolo[1,5-c]pyrimidin-5-ylamine
836-097-9Sch-582612-(Furan-2-yl)-7-phenethyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amineMFCD00933778CHEMBL17127BDBM500484667-(2-phenylethyl)-5-amino-2-(2-furyl)-pyrazolo-[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidine7H-Pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine, 2-(2-furanyl)-7-(2-phenylethyl)-

데이터베이스 식별자

CAS
160098-96-4
PubChem CID
176408
DTXSID
DTXSID80166799
ChEMBL
CHEMBL17127
ChEBI
CHEBI:93424
UNII
4309023MAH
EC Number
836-097-9
Nikkaji
J739.693G

물성

구조 계산 물성

XLogP
2.4
극성 표면적
100 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
26

물리화학적 성질

녹는점
223 °C · 223 °C
밀도
1.54 · 1.54±0.1 g/cm3(Predicted)
저장 조건
2 · Keep in dark place,Inert atmosphere,2-8°C
용해도
10 mg/mL, · DMSO: >10mg/mL, 가용성
물리적 상태
고체
산도 계수 (pKa)
2.78 · 2.78±0.30(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk
3
HS 번호
2934.99.3000
스토리지 클래스
11 - Combustible Solids

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

Drugs intended to prevent damage to the brain or spinal cord from ischemia, stroke, convulsions, or trauma. Some must be administered before the event, but others may be effective for some time after. They act by a variety of mechanisms, but often directly or indirectly minimize the damage produced by endogenous excitatory amino acids.

Compounds that selectively bind to and block the activation of ADENOSINE A2 RECEPTORS.

응용 분야

용도SCH 58261 is a potent and selective A2A adenosine receptor antagonist.

상·하류 제품 정보

공급사50 곳

南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

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2-(2-Furanyl)-7-(2-phenylethyl)-7H-pyrazolo(4,3-e)(1,2,4)triazolo(1,5-c)pyrimidin-5-amine (HCID 176408)｜Huagongshe