(S)-5-Bromo-N-(4-(chlorodifluoromethoxy)phenyl)-6-(3-hydroxypyrrolidin-1-yl)nicotinamide

HCID 86702602CAS 1492885-20-7

기본 정보

표준 SMILES
O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1cnc(N2CC[C@H](O)C2)c(Br)c1
InChIKey
IZADWXVPQKCEST-LBPRGKRZSA-N
분자식
C17H15BrClF2N3O3
평균 분자량
462.7 g/mol

이름 및 식별자

우선 이름
(S)-5-Bromo-N-(4-(chlorodifluoromethoxy)phenyl)-6-(3-hydroxypyrrolidin-1-yl)nicotinamide
IUPAC
5-bromo-N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3S)-3-hydroxypyrrolidin-1-yl]pyridine-3-carboxamide

이름 및 동의어

(S)-5-Bromo-N-(4-(chlorodifluoromethoxy)phenyl)-6-(3-hydroxypyrrolidin-1-yl)nicotinamide(S)-5-Bromo-N-[4-(chlorodifluoromethoxy)phenyl]-6-(3-hydroxypyrrolidin-1-yl)nicotinamide6K4PAL38F4SCHEMBL153885655-Bromo-N-(4-(chlorodifluoromethoxy)phenyl)-6-(3-hydroxypyrrolidin-1-yl)nicotinamide, (S)-1492885-20-73-Pyridinecarboxamide, 5-bromo-N-[4-(chlorodifluoromethoxy)phenyl]-6-[(3S)-3-hydroxy-1-pyrrolidinyl]-5-Bromo-N-[4-(chlorodifluoromethoxy)phenyl]-6-[(3S)-3-hydroxy-1-pyrrolidinyl]-3-pyridinecarboxamide

데이터베이스 식별자

CAS
1492885-20-7
PubChem CID
86702602
UNII
6K4PAL38F4

물성

구조 계산 물성

XLogP
3.8
극성 표면적
74.7 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
7
회전 가능 결합 수
5
무거운 원자 수
27

관련 반응

4건

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