4-[5-(Bromomethyl)-1,3-oxazol-2-yl]-6-chloro-1-(phenylsulfonyl)-1H-indazole

HCID 59564713

기본 정보

표준 SMILES
O=S(=O)(c1ccccc1)n1ncc2c(-c3ncc(CBr)o3)cc(Cl)cc21
InChIKey
DHKHUINGHBLMDY-UHFFFAOYSA-N
분자식
C17H11BrClN3O3S
평균 분자량
452.7 g/mol

이름 및 식별자

우선 이름
4-[5-(Bromomethyl)-1,3-oxazol-2-yl]-6-chloro-1-(phenylsulfonyl)-1H-indazole
IUPAC
2-[1-(benzenesulfonyl)-6-chloroindazol-4-yl]-5-(bromomethyl)-1,3-oxazole

이름 및 동의어

1254036-84-42-[1-(benzenesulfonyl)-6-chloroindazol-4-yl]-5-(bromomethyl)-1,3-oxazole1-(benzenesulfonyl)-4-[5-(bromomethyl)-1,3-oxazol-2-yl]-6-chloro-1H-indazole4-[5-(Bromomethyl)-1,3-oxazol-2-yl]-6-chloro-1-(phenylsulfonyl)-1H-indazoleSCHEMBL456984DHKHUINGHBLMDY-UHFFFAOYSA-NDA-215275-(bromomethyl)-2-(6-chloro-1-(phenylsulfonyl)-1H-indazol-4-yl)oxazole

데이터베이스 식별자

PubChem CID
59564713

물성

구조 계산 물성

XLogP
4.1
극성 표면적
86.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
4
무거운 원자 수
26

관련 반응

19건

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