3-bromo-4-[(2,4-difluorobenzyl)oxy]-1-(2,6-difluorophenyl)-5-(1,2-dihydroxyethyl)-6-methylpyridin-2(1H)-one (HCID 22050039)

기본 정보

표준 SMILES: Cc1c(C(O)CO)c(OCc2ccc(F)cc2F)c(Br)c(=O)n1-c1c(F)cccc1F
InChIKey: WTRSPVVMJFOZIG-UHFFFAOYSA-N
분자식: C21H16BrF4NO4
평균 분자량: 502.3 g/mol

이름 및 식별자

우선 이름: 3-bromo-4-[(2,4-difluorobenzyl)oxy]-1-(2,6-difluorophenyl)-5-(1,2-dihydroxyethyl)-6-methylpyridin-2(1H)-one
IUPAC: 3-bromo-1-(2,6-difluorophenyl)-4-[(2,4-difluorophenyl)methoxy]-5-(1,2-dihydroxyethyl)-6-methylpyridin-2-one

이름 및 동의어

SCHEMBL4381074WTRSPVVMJFOZIG-UHFFFAOYSA-N3-bromo-4-[(2,4-difluorobenzyl)oxy]-1-(2,6-difluorophenyl)-5-(1,2-dihydroxyethyl)-6-methylpyridin-2(1H)-one3-bromo-4-[(2,4-difluorobenzyl)oxy]-1-(2,6-difluorophenyl)-5-(1,2-dihydroxyethyl)-6-methylpyridin-2-(1H)-one

데이터베이스 식별자

PubChem CID: 22050039

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 70 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 8
회전 가능 결합 수: 6
무거운 원자 수: 31
형식 전하: 0
복잡도: 739

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