S29434
HIT212038209
sdf文件结构编辑类似物检索
HIT ID: HIT212038209
Cas No: 874484-20-5
分子式: C21H18N4O3
分子量: 374.4
常用名: S29434
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 2.534977
IUPAC: N-(2-{5-methoxy-1,6,11-triazatetracyclo[7.7.0.0^{2,7}.0^{10,15}]hexadeca-2,4,6,8,10,12,14-heptaen-8-yl}ethyl)furan-2-carboxamide
IUPAC: N-(2-{5-methoxy-1,6,11-triazatetracyclo[7.7.0.0^{2,7}.0^{10,15}]hexadeca-2,4,6,8,10,12,14-heptaen-8-yl}ethyl)furan-2-carboxamide
SMILES: COc1ccc2n3Cc4cccnc4-c3c(CCNC(=O)c3ccco3)c2n1
SMILES: COc1ccc2n3Cc4cccnc4-c3c(CCNC(=O)c3ccco3)c2n1
InChI key: XJIUMLVQBQKCJA-UHFFFAOYSA-N
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