기본 정보
- 표준 SMILES
COc1ccc(-c2sc3cc(OC)ccc3c2C(=O)c2ccc(O)cc2)cc1- InChIKey
YEYASRFTCLKCFD-UHFFFAOYSA-N- 분자식
- C23H18O4S
- 평균 분자량
- 390.5 g/mol
- 단동위원소 질량
- 390.09258022
이름 및 식별자
- 우선 이름
- 2-(4-Methoxyphenyl)-3-(4-Hydroxybenzoyl)-6-Methoxybenzo[b]thiophene
- IUPAC
- (4-hydroxyphenyl)-[6-methoxy-2-(4-methoxyphenyl)-1-benzothiophen-3-yl]methanone
이름 및 동의어
SCHEMBL1665792YEYASRFTCLKCFD-UHFFFAOYSA-NDB-1310632-(4-Methoxyphenyl)-3-(4-Hydroxybenzoyl)-6-Methoxybenzo[b]thiophene6-Methoxy-2-(4-methoxyphenyl)-3-(4-hydroxybenzoyl)benzo[b]thiophene(4-Hydroxyphenyl)[6-methoxy-2-(4-methoxyphenyl)benzo[b]thien-3-yl]methanone(4-hydroxyphenyl)[6-methoxy-2-(4-methoxyphenyl)benzo[b]thiophen-3-yl]methanone[2-(4-Methoxyphenyl)-6-methoxybenzo[b]thien-3-yl][4-hydroxyphenyl]methanone[6-Methoxy-2-(4-methoxy-phenyl)-benzo[b]thiophen-3-yl]-(4-hydroxy-phenyl)-methanone[6-Methoxy-2-(4-methoxyphenyl)benzo [b]thiophen-3-yl](4-hydroxyphenyl)methanone[6-methoxy-2-(4-methoxyphenyl)benzo[b]thien-3-yl][4-hydroxyphenyl]methanone[6-Methoxy-2-(4-methoxyphenyl)benzo[b]thiophen-3-yl](4-hydroxyphenyl)methanone
이름 더 보기
63676-19-7
데이터베이스 식별자
- PubChem CID
- 9865197
- Nikkaji
- J3.479.265H
물성
구조 계산 물성
- XLogP
- 5.5
- 극성 표면적
- 84 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 525
관련 반응
42건
연결된 노트
불러오는 중…