BODIQPy-TPA
HIT218847614
sdf文件结构编辑类似物检索
HIT ID: HIT218847614
Cas No: 2738333-02-1
分子式: C33H23BF2N4O
分子量: 540.38
常用名: BODIQPy-TPA
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 13-[(1E)-2-[4-(diphenylamino)phenyl]ethenyl]-17,17-difluoro-2-oxo-1,9,16lambda5-triaza-17-boratetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-3,5,7,9,11,13,15-heptaen-16-ylium-17-uide
IUPAC: 13-[(1E)-2-[4-(diphenylamino)phenyl]ethenyl]-17,17-difluoro-2-oxo-1,9,16lambda5-triaza-17-boratetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-3,5,7,9,11,13,15-heptaen-16-ylium-17-uide
SMILES: F[B-]1(F)n2c(nc3ccccc3c2=O)-c2cc(\C=C\c3ccc(cc3)N(c3ccccc3)c3ccccc3)cc[n+]12
SMILES: F[B-]1(F)n2c(nc3ccccc3c2=O)-c2cc(\C=C\c3ccc(cc3)N(c3ccccc3)c3ccccc3)cc[n+]12
InChI key: SFCLVYGKZSXEAX-FOCLMDBBSA-N
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