Methyl (1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]cyclohexanecarboxylate

HCID 67304345

기본 정보

표준 SMILES
COC(=O)[C@H]1CC(=O)CC[C@@H]1C(=O)N1CCN(c2ccccc2)CC1
InChIKey
WGTSJOQBKPYHJA-IRXDYDNUSA-N
분자식
C19H24N2O4
평균 분자량
344.4 g/mol

이름 및 식별자

우선 이름
Methyl (1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]cyclohexanecarboxylate
IUPAC
trans-methyl (1S,2S)-5-oxo-2-(4-phenylpiperazine-1-carbonyl)cyclohexane-1-carboxylate

이름 및 동의어

SCHEMBL2173170WGTSJOQBKPYHJA-IRXDYDNUSA-Nmethyl (1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]-cyclohexanecarboxylatemethyl (1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]cyclohexane-carboxylatemethyl (1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]cyclohexanecarboxylatemethyl(1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]-cyclohexanecarboxylatemethyl(1S,2S)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]cyclohexane-carboxylatemethyl(1s,2s)-5-oxo-2-[(4-phenylpiperazin-1-yl)carbonyl]cyclohexanecarboxylate

데이터베이스 식별자

PubChem CID
67304345

물성

구조 계산 물성

XLogP
1
극성 표면적
66.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
4
무거운 원자 수
25

관련 반응

6건

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