4(3H)-Quinazolinone, 2-methyl-3-(2-pyridyl)-

HCID 64049CAS 890-03-9

基本情報

標準SMILES: Cc1nc2ccccc2c(=O)n1-c1ccccn1
InChIKey: MFJAQXJDYDHLQK-UHFFFAOYSA-N
分子式: C14H11N3O
平均分子量: 237.26 g/mol
単同位体質量: 237.09021197

名称と識別子

優先名称: 4(3H)-Quinazolinone, 2-methyl-3-(2-pyridyl)-
IUPAC: 2-methyl-3-pyridin-2-ylquinazolin-4-one

名称と別名

890-03-94(3H)-Quinazolinone, 2-methyl-3-(2-pyridyl)-B 212BRN 08841252-Methyl-3-(2-pyridyl)-4(3H)-quinazolinone2-Methyl-3-(beta-pyridyl)chinazolon-(4) [German]2-Methyl-3-(beta-pyridyl)chinazolon-(4)DTXSID002374755-24-03-00163 (Beilstein Handbook Reference)RefChem:283881DTXCID001599662-methyl-3-(2-pyridinyl)-4(3H)-quinazolinone

名称をさらに表示

2-methyl-3-(2-pyridyl)-3-hydroquinazolin-4-one2-methyl-3-pyridin-2-ylquinazolin-4-one2-Methyl-3-pyridin-2-yl-3H-quinazolin-4-one2-Methyl-3-(pyridin-2-yl)quinazolin-4(3H)-oneOprea1_116779Oprea1_347875MLS000109009SCHEMBL1963616

データベース識別子

CAS: 890-03-9
PubChem CID: 64049
DTXSID: DTXSID00237475
ChEMBL: CHEMBL1401792
Nikkaji: J73.427F

物性

構造計算による物性

XLogP: 1.7
極性表面積: 45.6 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 18
形式電荷: 0
複雑度: 366