기본 정보
- 표준 SMILES
CN(Cc1ccc(F)cc1)C(=O)C1=C(O)C(=O)N(CCc2ccc(Cl)cc2)C1- InChIKey
JLVDXHLFOUTJBX-UHFFFAOYSA-N- 분자식
- C21H20ClFN2O3
- 평균 분자량
- 402.8 g/mol
이름 및 식별자
- 우선 이름
- 1-[2-(4-chlorophenyl)ethyl]-N-[(4-fluorophenyl)methyl]-4-hydroxy-N-methyl-5-oxo-2H-pyrrole-3-carboxamide
- IUPAC
- 1-[2-(4-chlorophenyl)ethyl]-N-[(4-fluorophenyl)methyl]-4-hydroxy-N-methyl-5-oxo-2H-pyrrole-3-carboxamide
이름 및 동의어
JLVDXHLFOUTJBX-UHFFFAOYSA-N1-[2(4-chloro-phenyl)-ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1h-pyrrole-3-carboxylic acid (4-fluoro-benzyl)-methyl amide1-[2-(4-Chloro-phenyl)ethyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxylic acid (4-fluoro-benzyl)-methyl amide1-[2-(4-chlorophenyl)ethyl]-N-[(4-fluorophenyl)methyl]-4-hydroxy-N-methyl-5-oxo-2H-pyrrole-3-carboxamide1H-Pyrrole-3-carboxamide, 1-[2-(4-chlorophenyl)ethyl]-N-[(4-fluorophenyl)methyl]-2,5-dihydro-4-hydroxy-N-methyl-5-oxo-
데이터베이스 식별자
- PubChem CID
- 54698183
물성
구조 계산 물성
- XLogP
- 3.6
- 극성 표면적
- 60.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 611
관련 반응
2건
화합물 노트
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