BDP TMR azide
HIT218847548
sdf文件结构编辑类似物检索
HIT ID: HIT218847548
Cas No: 2183473-25-6
分子式: C24H27BF2N6O2
分子量: 480.33
常用名: BDP TMR azide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-{2-[(3-azidopropyl)carbamoyl]ethyl}-2,2-difluoro-12-(4-methoxyphenyl)-4,6-dimethyl-1lambda5,3-diaza-2-boratricyclo[7.3.0.0^{3,7}]dodeca-1(12),4,6,8,10-pentaen-1-ylium-2-uide
IUPAC: 5-{2-[(3-azidopropyl)carbamoyl]ethyl}-2,2-difluoro-12-(4-methoxyphenyl)-4,6-dimethyl-1lambda5,3-diaza-2-boratricyclo[7.3.0.0^{3,7}]dodeca-1(12),4,6,8,10-pentaen-1-ylium-2-uide
SMILES: COc1ccc(cc1)C1=[N+]2C(C=C1)=Cc1c(C)c(CCC(=O)NCCCN=[N+]=[N-])c(C)n1[B-]2(F)F
SMILES: COc1ccc(cc1)C1=[N+]2C(C=C1)=Cc1c(C)c(CCC(=O)NCCCN=[N+]=[N-])c(C)n1[B-]2(F)F
InChI key: RDEBWDYUAWKFLF-UHFFFAOYSA-N
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