6-(4-Chlorophenyl)-9,9-dimethyl-5-(2-phenylacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
기본 정보
- CAS
312621-61-7- 표준 SMILES
CC1(C)CC(=O)C2=C(C1)Nc1ccccc1N(C(=O)Cc1ccccc1)C2c1ccc(Cl)cc1- InChIKey
OIVHRCSQXFRAKW-UHFFFAOYSA-N- 분자식
- C29H27ClN2O2
- 평균 분자량
- 471 g/mol
이름 및 식별자
- 우선 이름
- 6-(4-Chlorophenyl)-9,9-dimethyl-5-(2-phenylacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
- IUPAC
- 6-(4-chlorophenyl)-9,9-dimethyl-5-(2-phenylacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
- 영어명
- 11-(4-chlorophenyl)-3,3-dimethyl-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
- 분자식
- C29H27ClN2O2
- 분자량
- 470.99
이름 및 동의어
312621-61-711-(4-chlorophenyl)-3,3-dimethyl-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one6-(4-chlorophenyl)-9,9-dimethyl-5-(2-phenylacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one11-(4-CHLOROPHENYL)-3,3-DIMETHYL-10-(2-PHENYLACETYL)-2,3,4,5,10,11-HEXAHYDRO-1H-DIBENZO[B,E][1,4]DIAZEPIN-1-ONECBMicro_026772CID 2856841Oprea1_857852STK868315AKOS001631337ST005489BIM-0026642.P001AK-968/36944099
이름 더 보기
1H-Dibenzo[b,e][1,4]diazepin-1-one, 11-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-3,3-dimethyl-10-(2-phenylacetyl)-
SR-01000433109SR-01000433109-111-(4-chlorophenyl)-3,3-dimethyl-10-(2-phenylacetyl)-2,3,4-trihydro-5H,11H-ben zo[b]benzo[2,1-f]1,4-diazepin-1-one
데이터베이스 식별자
- CAS
312621-61-7
물성
구조 계산 물성
- XLogP
- 5.8
- 극성 표면적
- 49.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 807
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…