(S)-1-(3,3-Dimethyl-2-oxo-pentanoyl)-pyrrolidine-2-carboxylic acid 3-phenyl-propyl ester

HCID 9906857

기본 정보

표준 SMILES
CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1ccccc1
InChIKey
NDOQQTZEXVGVQK-KRWDZBQOSA-N
분자식
C21H29NO4
평균 분자량
359.5 g/mol

이름 및 식별자

우선 이름
(S)-1-(3,3-Dimethyl-2-oxo-pentanoyl)-pyrrolidine-2-carboxylic acid 3-phenyl-propyl ester
IUPAC
3-phenylpropyl (2S)-1-(3,3-dimethyl-2-oxopentanoyl)pyrrolidine-2-carboxylate

이름 및 동의어

CHEMBL338562SCHEMBL3426604NDOQQTZEXVGVQK-KRWDZBQOSA-NBDBM50067007AKOS024437674(S)-1-(3,3-Dimethyl-2-oxo-pentanoyl)-pyrrolidine-2-carboxylic acid 3-phenyl-propyl ester3-Phenyl-1-propyl (2S)-1-(3,3-dimethyl-1 2-dioxopentyl)-2-pyrrolidinecarboxylate3-Phenyl-1-propyl (2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-2-pyrrolidinecarboxylate3-Phenyl-1-propyl (2S)-1-(3.3-dimethyl-1,2-dioxopentyl)-2-pyrrolidinecarboxylate3-phenyl-l-propyl (2S)-l-(3,3-dimethyl-1,2-dioxopentyl)-2-pyrrolidinecarboxylate

데이터베이스 식별자

PubChem CID
9906857
ChEMBL
CHEMBL338562
Nikkaji
J1.029.676E

물성

구조 계산 물성

XLogP
4.1
극성 표면적
63.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
9
무거운 원자 수
26

관련 반응

19건

화합물 노트

불러오는 중…