5-Bromo-6-[hydroxy[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione

HCID 5282528
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CC(C)Cn1c(=O)n(C)c(=O)c2c(Br)c(C(O)c3ccccc3C(F)(F)F)sc21
InChIKey
SOGCGWKUEAMEOS-UHFFFAOYSA-N
분자식
C19H18BrF3N2O3S
평균 분자량
491.3 g/mol

이름 및 식별자

우선 이름
5-Bromo-6-[hydroxy[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
IUPAC
5-bromo-6-[hydroxy-[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione

이름 및 동의어

5-Bromo-6-[hydroxy[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dioneSCHEMBL63440205-bromo-6-[hydroxy[2-(trifluoromethyl)phenyl]methyl]-3-methyl-1-(2-methylpropyl)-thieno[2,3-d]pyrimidine-2,4(1h,3h)-dione5-Bromo-6-{hydroxy[2-(trifluoromethyl)phenyl]methyl}-1-isobutyl-3-methyl-thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione

데이터베이스 식별자

PubChem CID
5282528

물성

구조 계산 물성

XLogP
4.6
극성 표면적
89.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
7
회전 가능 결합 수
4
무거운 원자 수
29

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