N-[(4-chlorophenyl)methyl]-6-[(4-fluoro-3,6-dihydro-2H-pyridin-1-yl)methyl]-1-methyl-4-oxo-quinoline-3-carboxamide

HCID 16073869
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기본 정보

표준 SMILES
Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(CN3CC=C(F)CC3)ccc21
InChIKey
SSNWNBDTCIPEAD-UHFFFAOYSA-N
분자식
C24H23ClFN3O2
평균 분자량
439.9 g/mol
단동위원소 질량
439.1462828

이름 및 식별자

우선 이름
N-[(4-chlorophenyl)methyl]-6-[(4-fluoro-3,6-dihydro-2H-pyridin-1-yl)methyl]-1-methyl-4-oxo-quinoline-3-carboxamide
IUPAC
N-[(4-chlorophenyl)methyl]-6-[(4-fluoro-3,6-dihydro-2H-pyridin-1-yl)methyl]-1-methyl-4-oxoquinoline-3-carboxamide

이름 및 동의어

SCHEMBL6700293SSNWNBDTCIPEAD-UHFFFAOYSA-N3-Quinolinecarboxamide, N-[(4-chlorophenyl)methyl]-6-[(4-fluoro-3,6-dihydro-1(2H)-pyridinyl)methyl]-1,4-dihydro-1-methyl-4-oxo-N-(4-Chlorobenzyl)-6-((4-fluoro-3,6-dihydro-1(2H)-pyridinyl)methyl)-1-methyl-4-oxo-1,4-dihydro-3-quinolinecarboxamideN-[(4-chlorophenyl)methyl]-6-[(4-fluoro-3,6-dihydro-2H-pyridin-1-yl)methyl]-1-methyl-4-oxo-quinoline-3-carboxamide

데이터베이스 식별자

PubChem CID
16073869

물성

구조 계산 물성

XLogP
4.2
극성 표면적
52.7 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
5
무거운 원자 수
31

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