4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-N-(3-fluorophenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-N-(3-fluorophenyl)-1,4-diazepane-1-carboxamide
4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-N-(3-fluorophenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V006-7345 |
| Compound Name: | 4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-N-(3-fluorophenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C30 H30 F N5 O |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2)c(nc(c2ccccc2)n1)N1CCCN(CC1)C(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0031 |
| logD: | 6.928 |
| logSw: | -5.705 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.837 |
| InChI Key: | BIRZJPKKPOXADY-UHFFFAOYSA-N |