(+)-7-([5-(1-cyclopropyl-2,2,2-trifluoro-1-hydroxyethyl)-1,3-thiazol-2-yl]thio}-4-(4-fluorophenyl)-2H-chromen-2-one

HCID 11363891

기본 정보

표준 SMILES
O=c1cc(-c2ccc(F)cc2)c2ccc(Sc3ncc(C(O)(C4CC4)C(F)(F)F)s3)cc2o1
InChIKey
ICRVAARUEBKSDA-UHFFFAOYSA-N
분자식
C23H15F4NO3S2
평균 분자량
493.5 g/mol

이름 및 식별자

우선 이름
(+)-7-([5-(1-cyclopropyl-2,2,2-trifluoro-1-hydroxyethyl)-1,3-thiazol-2-yl]thio}-4-(4-fluorophenyl)-2H-chromen-2-one
IUPAC
7-[[5-(1-cyclopropyl-2,2,2-trifluoro-1-hydroxyethyl)-1,3-thiazol-2-yl]sulfanyl]-4-(4-fluorophenyl)chromen-2-one

이름 및 동의어

(+)-7-([5-(1-cyclopropyl-2,2,2-trifluoro-1-hydroxyethyl)-1,3-thiazol-2-yl]thio}-4-(4-fluorophenyl)-2H-chromen-2-one(+)-7-{[5-(1-cyclopropyl-2,2,2-trifluoro-1-hydroxyethyl)-1,3-thiazol-2-yl]thio}-4-(4-fluorophenyl)-2H-chromen-2-oneSCHEMBL2980039(-)-7-{[5-(1-cyclopropyl-2,2,2-trifluoro-1-hydroxyethyl)-1,3-thiazol-2-yl]thio}-4-(4-fluorophenyl)-2H-chromen-2-one

데이터베이스 식별자

PubChem CID
11363891

물성

구조 계산 물성

XLogP
5.5
극성 표면적
113 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
10
회전 가능 결합 수
5
무거운 원자 수
33

관련 반응

4건

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