HIT ID: HIT218833007

Cas No:

分子式: C31H31F4N5O9

分子量: 693.609

常用名: 2-amino-N-[({[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.0^{2,14}.0^{4,13}.0^{6,11}.0^{20,24}]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]carbamoyl}methoxy)methyl]acetamide; trifluoroacetic acid, Deruxtecan analog 2 monoTFA

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 2-amino-N-[({[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.0^{2,14}.0^{4,13}.0^{6,11}.0^{20,24}]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]carbamoyl}methoxy)methyl]acetamide; trifluoroacetic acid

SMILES: OC(=O)C(F)(F)F.CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4cc(F)c(C)c5CC[C@H](NC(=O)COCNC(=O)CN)c(c3Cn1c2=O)c45

InChI key: DXZHUKXYWJZGIG-XUEJMOKYSA-N