2PC69SX5ZB

HCID 10595107

기본 정보

CAS
173864-46-5
표준 SMILES
CCOC(=O)C1C(c2ccc(OC)cc2)=NCC1c1ccc2c(c1)OCO2
InChIKey
GTQMULSWASGYOW-UHFFFAOYSA-N
분자식
C21H21NO5
평균 분자량
367.4 g/mol

이름 및 식별자

우선 이름
2PC69SX5ZB
IUPAC
ethyl 3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-3,4-dihydro-2H-pyrrole-4-carboxylate

이름 및 동의어

2PC69SX5ZBSCHEMBL4995187GTQMULSWASGYOW-UHFFFAOYSA-NEthyl 3-(1,3-benzodioxol-5-yl)-3,4-dihydro-5-(4-methoxyphenyl)-2H-pyrrole-4-carboxylateEthyl 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-4,5-dihydro-3H-pyrrole-3-carboxylate173864-46-52H-Pyrrole-4-carboxylic acid, 3-(1,3-benzodioxol-5-yl)-3,4-dihydro-5-(4-methoxyphenyl)-, ethyl esterethyl 2-(4-methoxyphenyl)-4-(3,4-methylenedioxyphenyl)-4,5-dihydro-3H -pyrrole-3-carboxylateethyl 2-(4-methoxyphenyl)-4-(3,4-methylenedioxyphenyl)-4,5-dihydro-3H-pyrrole-3-carboxylate

데이터베이스 식별자

CAS
173864-46-5
PubChem CID
10595107
UNII
2PC69SX5ZB

물성

구조 계산 물성

XLogP
3.3
극성 표면적
66.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
6
무거운 원자 수
27

관련 반응

9건

화합물 노트

불러오는 중…

CAS 173864-46-5 2PC69SX5ZB (HCID 10595107)|Huagongshe