N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-1H-benzimidazole-5-carboxamide
Chemical Structure Depiction of
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-1H-benzimidazole-5-carboxamide
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-1H-benzimidazole-5-carboxamide
Compound characteristics
| Compound ID: | SC87-0610 |
| Compound Name: | N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-1H-benzimidazole-5-carboxamide |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C24 H22 F N5 O2 |
| Smiles: | C1CC2=C(CCC1CNC(c1ccc3c(c1)nc[nH]3)=O)N=C(c1ccc(cc1)F)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5135 |
| logD: | 1.4321 |
| logSw: | -2.8802 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.136 |
| InChI Key: | BDXCRPAKFNBGTM-CQSZACIVSA-N |