기본 정보
- CAS
120205-53-0- 표준 SMILES
CC[C@H](C)[C@@H]([C@@H](CC(=O)OC(C)(C)C)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C)C(C)C- InChIKey
MAYJVBBZJLABTA-HUMDQVGNSA-N- 분자식
- C26H51N3O5
- 평균 분자량
- 485.7 g/mol
이름 및 식별자
- 우선 이름
- (3R,4S,5S)-Tert-butyl 4-((S)-2-((S)-2-(dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamido)-3-methoxy-5-methylheptanoate
- IUPAC
- tert-butyl (3R,4S,5S)-4-[[(2S)-2-[[(2S)-2-(dimethylamino)-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoate
- 영어명
- L-ValinaMide, N,N-diMethyl-L-valyl-N-[(1S,2R)-4-(1,1-diMethylethoxy)-2-Methoxy-1-[(1S)-1-Methylpropyl]-4-oxobutyl]-N-Methyl-
- 분자식
- C26H51N3O5
- 분자량
- 485.7
이름 및 동의어
120205-53-0(3R,4S,5S)-TERT-BUTYL 4-((S)-2-((S)-2-(DIMETHYLAMINO)-3-METHYLBUTANAMIDO)-N,3-DIMETHYLBUTANAMIDO)-3-METHOXY-5-METHYLHEPTANOATEL-Valinamide, N,N-dimethyl-L-valyl-N-[(1S,2R)-4-(1,1-dimethylethoxy)-2-methoxy-1-[(1S)-1-methylpropyl]-4-oxobutyl]-N-methyl-MFCD28167844tert-butyl (3R,4S,5S)-4-[[(2S)-2-[[(2S)-2-(dimethylamino)-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoatetert-butyl (3R,4S,5S)-4-[[(2S)-2-[[(2S)-2-(dimethylamino)-3-methyl-butanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-3-methoxy-5-methyl-heptanoateDov-Val-Dil-OtBuC26H51N3O5tert-butyl (3R,4S,5S)-4-((S)-2-((S)-2-(dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamido)-3-methoxy-5-methylheptanoatetert-Butyl (3R,4S,5S)-4-[(S)-2-[(S)-2-(Dimethylamino)-3-methylbutanamido]-N,3-dimethylbutanamido]-3-methoxy-5-methylheptanoateSCHEMBL4965613CHEMBL5197739
이름 더 보기
tert-butyl (3R,4S,5S)-4-((S)-2-((S)-2-(dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamido)-3-methoxy-5-methylheptanoate hydrochloride
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 88.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 15
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 657
물리화학적 성질
- 끓는 점
- 593.9 · 593.9±50.0 °C(Predicted)
- 밀도
- 0.995 · 0.995±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C, stored under nitrogen
- 산도 계수 (pKa)
- 13.95 · 13.95±0.46(Predicted)
공급사
불러오는 중…
공개 문의
불러오는 중…
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…