2-acetylamino-N-[2-[2-(1-benzyl-1H-imidazol-4-ylmethyl)-5-naphthalen-2-ylmethyl-3-oxo-piperazin-1-yl]-1-(4-fluorobenzyl)-2-oxo-ethyl]-3-(4-hydroxyphenyl)-propionamide

HCID 69652750
노트반응
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기본 정보

표준 SMILES
CC(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(F)cc1)C(=O)N1CC(Cc2ccc3ccccc3c2)NC(=O)C1Cc1cn(Cc2ccccc2)cn1
InChIKey
UDVVYDKPSMZRSR-UHFFFAOYSA-N
분자식
C46H45FN6O5
평균 분자량
780.9 g/mol

이름 및 식별자

우선 이름
2-acetylamino-N-[2-[2-(1-benzyl-1H-imidazol-4-ylmethyl)-5-naphthalen-2-ylmethyl-3-oxo-piperazin-1-yl]-1-(4-fluorobenzyl)-2-oxo-ethyl]-3-(4-hydroxyphenyl)-propionamide
IUPAC
2-acetamido-N-[1-[2-[(1-benzylimidazol-4-yl)methyl]-5-(naphthalen-2-ylmethyl)-3-oxopiperazin-1-yl]-3-(4-fluorophenyl)-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide

이름 및 동의어

SCHEMBL6069732UDVVYDKPSMZRSR-UHFFFAOYSA-N2-acetylamino-N-[2-[2-(1-benzyl -1H-imidazol-4-ylmethyl)-5-naphthalen-2-ylmehtyl-3-oxo-piperazin-1-yl]-1-(4-fluorobenzyl)-2-oxo-ethyl]-3-(4-hydroxyphenyl)-propionamide2-acetylamino-N-[2-[2-(1-benzyl-1H-imidazol-4-ylmethyl)-5-naphthalen-2-ylmehtyl-3-oxo-piperazin-1-yl]-1-(4-fluorobenzyl)-2-oxo-ethyl]-3-(4-hydroxyphenyl)-propionamide2-acetylamino-N-[2-[2-(1-benzyl-1H-imidazol-4-ylmethyl)-5-naphthalen-2-ylmethyl-3-oxo-piperazin-1-yl]-1-(4-fluorobenzyl)-2-oxo-ethyl]-3-(4-hydroxyphenyl)-propionamide2-acetylamino-N-[2-[2-(1-benzyl-1H-imidazol-4-ylmethyl)-5-naphthalen-2-ylmethyl-3-oxo-piperazin-1-yl]-1-(4-fluorobenzyl)-2-oxo-ethyl]-3-(4-hydroxyphenyl)propionamide

데이터베이스 식별자

PubChem CID
69652750

물성

구조 계산 물성

XLogP
6.2
극성 표면적
146 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
7
회전 가능 결합 수
14
무거운 원자 수
58

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