기본 정보
- 표준 SMILES
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21- InChIKey
JRGCKZXFOYTGEH-MZXCDDGRSA-N- 분자식
- C35H39N3O5
- 평균 분자량
- 581.7 g/mol
이름 및 식별자
- 우선 이름
- (2S,4S)-tert-butyl 4-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-2-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidine-1-carboxylate
- IUPAC
- tert-butyl (2S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl]pyrrolidine-1-carboxylate
이름 및 동의어
SCHEMBL13164408SCHEMBL29547949SCHEMBL31039889JRGCKZXFOYTGEH-MZXCDDGRSA-N(2S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-[(R)-(1,2,3,4-tetrahydro-naphthalen-1-yl)carbamoyl]-pyrrolidine-1-carboxylic acid tert-butyl ester(2S,4S)-4-(9H-Fluoren-9-ylmethoxycarbonylamino)-2-[(R)-(1,2,3,4-tetrahydro-naphthalen-1yl)carbamoyl]-pyrrolidine-1-carboxylic acid tert-butyl ester(2S,4S)-tert-butyl 4-((((9H-fluoren-9-yl)methoxy)carbonyl) amino)-2-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidine-1-carboxylate(2S,4S)-tert-butyl 4-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-2-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidine-1-carboxylate1515873-60-5tert-Butyl (2S,4S)-4-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-2-(((R)-1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl)pyrrolidine-1-carboxylate
데이터베이스 식별자
- PubChem CID
- 57806828
물성
구조 계산 물성
- XLogP
- 5.8
- 극성 표면적
- 97 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 43
- 형식 전하
- 0
- 복잡도
- 990
관련 반응
6건
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