Toreforant
HIT212673441
sdf文件结构编辑类似物检索
HIT ID: HIT212673441
Cas No: 952494-46-1
分子式: C23H32N6
分子量: 392.551
常用名: Toreforant
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 3.9691315
IUPAC: 5-(5,7-dimethyl-1H-1,3-benzodiazol-2-yl)-4-methyl-N-[3-(1-methylpiperidin-4-yl)propyl]pyrimidin-2-amine
IUPAC: 5-(5,7-dimethyl-1H-1,3-benzodiazol-2-yl)-4-methyl-N-[3-(1-methylpiperidin-4-yl)propyl]pyrimidin-2-amine
SMILES: CN1CCC(CCCNc2ncc(-c3nc4cc(C)cc(C)c4[nH]3)c(C)n2)CC1
SMILES: CN1CCC(CCCNc2ncc(-c3nc4cc(C)cc(C)c4[nH]3)c(C)n2)CC1
InChI key: FCRFVPZAXGJLPW-UHFFFAOYSA-N
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