기본 정보
- CAS
86273-92-9- 표준 SMILES
Cc1ccc(S(=O)(=O)CCN2C(=O)CN=C(c3ccccc3Cl)c3cc(Cl)ccc32)cc1- InChIKey
FFZOBTGTWSRRMB-UHFFFAOYSA-N- 분자식
- C24H20Cl2N2O3S
- 평균 분자량
- 487.4 g/mol
- 단동위원소 질량
- 486.0571691
개요
Tolufazepam is a small molecule drug. The usage of the INN stem '-azepam' in the name indicates that Tolufazepam is a diazepam derivative. Tolufazepam has a monoisotopic molecular weight of 486.06 Da.
이름 및 식별자
- 우선 이름
- 7-Chloro-5-(2-chlorophenyl)-1,3-dihydro-1-(2-((4-methylphenyl)sulfonyl)ethyl)-2H-1,4-benzodiazepin-2-one
- IUPAC
- 7-chloro-5-(2-chlorophenyl)-1-[2-(4-methylphenyl)sulfonylethyl]-3H-1,4-benzodiazepin-2-one
- 현지명
- 톨루파제팜
- 영어명
- Tolufazepam
- 분자식
- C24H20Cl2N2O3S
- 분자량
- 487.4
이름 및 동의어
TolufazepamTolufazepamum86273-92-998SR74X50DDTXSID502354661-(4'-Methylphenylsulfonyl)ethyl-5-(2-chlorophenyl)-7-chloro-2H-1,4-benzodiazepin-2-oneRefChem:1074400DTXCID501579577-Chloro-5-(2-chlorophenyl)-1,3-dihydro-1-(2-((4-methylphenyl)sulfonyl)ethyl)-2H-1,4-benzodiazepin-2-oneTolufazepam [INN]7-chloro-5-(2-chlorophenyl)-1-[2-(4-methylphenyl)sulfonylethyl]-3H-1,4-benzodiazepin-2-oneInn Tolufazepam
이름 더 보기
톨루파제팜7-Chloro-5-(2-chlorophenyl)-1,3-dihydro-1-[2-[(4-methylphenyl)sulfonyl]ethyl]-2H-1,4-benzodiazepin-2-one2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(2-chlorophenyl)-1,3-dihydro-1-[2-[(4-methylphenyl)sulfonyl]ethyl]-
Tolufazepamum [Latin]UNII-98SR74X50DTOLUFAZEPAM [WHO-DD]SCHEMBL2109626CHEMBL21076332H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(2-chlorophenyl)-1-(2-((4-methylphenyl)sulfonyl)ethyl)-7-Chloro-5-(o-chlorophenyl)-1,3-dihydro-1-(2-(p-tolylsulfonyl)ethyl)-2H-1,4-benzodiazepin-2-oneNS00121299
데이터베이스 식별자
- CAS
86273-92-9- PubChem CID
- 65647
- DTXSID
DTXSID50235466- ChEMBL
CHEMBL2107633- UNII
- 98SR74X50D
- Nikkaji
- J23.313G
물성
구조 계산 물성
- XLogP
- 4.6
- 극성 표면적
- 75.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 805
물리화학적 성질
- 끓는 점
- 731.9 · 731.9±60.0 °C(Predicted)
- 밀도
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 1.37 · 1.37±0.35(Predicted)
화학 및 산업
공급사1 곳
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
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