기본 정보
- CAS
1228552-45-1- 표준 SMILES
COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1nc2ccc(Br)cc2[nH]1)C(C)C- InChIKey
VMVOGALUTOHLRC-GJZGRUSLSA-N- 분자식
- C18H23BrN4O3
- 평균 분자량
- 423.3 g/mol
- 단동위원소 질량
- 422.09535
이름 및 식별자
- 우선 이름
- methyl (S)-1-((S)-2-(6-bromo-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamate
- IUPAC
- methyl N-[(2S)-1-[(2S)-2-(6-bromo-1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
- 영어명
- RAVI-013
- 분자식
- C18H23BrN4O3
- 분자량
- 423.3
이름 및 동의어
1228552-45-1methyl (S)-1-((S)-2-(6-bromo-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamateMethyl ((S)-1-((S)-2-(6-bromo-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamateCarbamic acid, N-[(1S)-1-[[(2S)-2-(6-bromo-1H-benzimidazol-2-yl)-1-pyrrolidinyl]carbonyl]-2-methylpropyl]-, methyl esterMethyl N-[(1S)-1-[[(2S)-2-(6-bromo-1H-benzimidazol-2-yl)-1-pyrrolidinyl]carbonyl]-2-methylpropyl]carbamatemethyl N-[(2S)-1-[(2S)-2-(6-bromo-1H-benzimidazol-2-yl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamateSCHEMBL2706088SCHEMBL16868614WZG0161VMVOGALUTOHLRC-GJZGRUSLSA-NDTXSID301110201methyl ((S)-1-((S)-2-(5-bromo-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-yl)carbamate
이름 더 보기
RAVI-013Oliceridine Impurity 11Methyl N-[(2S)-1-[(2S)-2-(6-bromo-1H-1,3-benzodiazol-2-yl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
DB-255156methyl (S)-1-((S)-2-(5-bromo-1H-benzo[d]imidazol-2-yl)-pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamatemethyl (S)-1-((S)-2-(5-bromo-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamatemethyl(S)-1-((S)-2-(6-bromo-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamate
물성
구조 계산 물성
- XLogP
- 3.1
- 극성 표면적
- 87.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 533
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