Topovale
HIT212711765
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HIT ID: HIT212711765
Cas No: 500214-53-9
分子式: C23H23N3O5
分子量: 421.453
常用名: Topovale
氢键受体数 (HBA): 7
氢键供体数 (HBD): 0
LogP: 2.0873663
IUPAC: 21-[2-(dimethylamino)ethyl]-16,17-dimethoxy-5,7-dioxa-11,21-diazapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{14,19}]henicosa-1(13),2(10),3,8,11,14(19),15,17-octaen-20-one
IUPAC: 21-[2-(dimethylamino)ethyl]-16,17-dimethoxy-5,7-dioxa-11,21-diazapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{14,19}]henicosa-1(13),2(10),3,8,11,14(19),15,17-octaen-20-one
SMILES: COc1cc2c3cnc4cc5OCOc5cc4c3n(CCN(C)C)c(=O)c2cc1OC
SMILES: COc1cc2c3cnc4cc5OCOc5cc4c3n(CCN(C)C)c(=O)c2cc1OC
InChI key: UVXCXZBZPFCAAJ-UHFFFAOYSA-N
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