기본 정보
- 표준 SMILES
Cc1cccc(C)c1OCC(=O)NC(Cc1ccccc1)C(O)CC(Cc1ccccc1)NC(=O)C(C(C)C)N1CCCNC1=O- InChIKey
KJHKTHWMRKYKJE-UHFFFAOYSA-N- 분자식
- C37H48N4O5
- 평균 분자량
- 628.8 g/mol
이름 및 식별자
- 우선 이름
- N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide
- IUPAC
- N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide
이름 및 동의어
N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamideC37H48N4O51217628-64-2(2R,4S,5S)-LopinavirLopinavir (ABT-378)SCHEMBL8171504HMS3654D21HMS5079F17(2s)-n-[(2s,4s,5s)-5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenyl-hexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamideXCC62554NSC740137s1380
이름 더 보기
AKOS032960319NSC-740137NCGC00389393-01CID 71749833LS-15397(S)-N-((2R,4S,5S)-5-(2-(2,6-DIMETHYLPHENOXY)ACETAMIDO)-4-HYDROXY-1,6-DIPHENYL-HEXN-2-YL)-3-METHYL-2-(2-OXOTETRAHYDROPYRIMIDIN-1(2H)-YL)BUTANAMIDE2649902-54-3N-(5-(2-(2,6-Dimethylphenoxy)acetamido)-4-hydroxy-1,6-diphenylhexan-2-yl)-3-methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanamide
데이터베이스 식별자
- PubChem CID
- 3817
물성
구조 계산 물성
- XLogP
- 5.9
- 극성 표면적
- 120 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 15
- 무거운 원자 수
- 46
- 형식 전하
- 0
- 복잡도
- 940
실험 및 물리화학적 성질
DrugsPharmaceuticals
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