6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carboxylic acid (3-methyl-1-pyridazin-3-yl-butyl)-amide

HCID 71105703

기본 정보

표준 SMILES
CC(C)CC(NC(=O)c1ccc(N2CC(F)(F)C2)c(OCC2CC2)n1)c1cccnn1
InChIKey
JNWQBXIJVLIUBQ-UHFFFAOYSA-N
분자식
C22H27F2N5O2
평균 분자량
431.5 g/mol

이름 및 식별자

우선 이름
6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carboxylic acid (3-methyl-1-pyridazin-3-yl-butyl)-amide
IUPAC
6-(cyclopropylmethoxy)-5-(3,3-difluoroazetidin-1-yl)-N-(3-methyl-1-pyridazin-3-ylbutyl)pyridine-2-carboxamide

이름 및 동의어

6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carboxylic acid (3-methyl-1-pyridazin-3-yl-butyl)-amideCHEMBL3932050SCHEMBL14226353BDBM210650US9290451, 321(+)-6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carboxylic acid (3-methyl-1-pyridazin-3-yl-butyl)-amide

데이터베이스 식별자

PubChem CID
71105703
ChEMBL
CHEMBL3932050

물성

구조 계산 물성

XLogP
3.3
극성 표면적
80.2 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
8
회전 가능 결합 수
9
무거운 원자 수
31

관련 반응

6건

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