기본 정보
- 표준 SMILES
CN(C(=O)/C=C/CC(C)(C)NC(=O)OC(C)(C)C)[C@H](Cc1cccc2ccccc12)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)NCC1CCCO1- InChIKey
ZEAVFKKKGKHAHW-AZAWFWMUSA-N- 분자식
- C41H54N4O6
- 평균 분자량
- 698.9 g/mol
이름 및 식별자
- 우선 이름
- ((3e)-1,1-Dimethyl-4-(methyl-((1r)-1-(methyl-((1r)-2-phenyl-1-(((tetrahydrofuran-2-yl)methyl)carbamoyl)ethyl)carbamoyl)-2(1-naphtyl)ethyl)-carbamoyl)but-3enyl)carbamic acid tert butylester
- IUPAC
- tert-butyl N-[(E)-2-methyl-6-[methyl-[(2R)-1-[methyl-[(2R)-1-oxo-1-(oxolan-2-ylmethylamino)-3-phenylpropan-2-yl]amino]-3-naphthalen-1-yl-1-oxopropan-2-yl]amino]-6-oxohex-4-en-2-yl]carbamate
이름 및 동의어
ZEAVFKKKGKHAHW-AZAWFWMUSA-N((3E)-1,1-dimethyl-4-(methyl-((1R)-1-(methyl-((1R)-2-phenyl-1-(((tetrahydrofuran-2-yl)methyl)carbamoyl)ethyl)carbamoyl)-2(1-naphtyl)ethyl)-carbamoyl)but-3-enyl)carbamic acid tert butylester((3e)-1,1-dimethyl-4-(methyl-((1r)-1-(methyl-((1r)-2-phenyl-1-(((tetrahydrofuran-2-yl)methyl)carbamoyl)ethyl)carbamoyl)-2(1-naphtyl)ethyl)-carbamoyl)but-3enyl)carbamic acid tert butylester
데이터베이스 식별자
- PubChem CID
- 10652293
물성
구조 계산 물성
- XLogP
- 6.3
- 극성 표면적
- 117 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 16
- 무거운 원자 수
- 51
- 형식 전하
- 0
- 복잡도
- 1,190
관련 반응
4건
화합물 노트
불러오는 중…