1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-3,3-dimethylbutan-1-one
Chemical Structure Depiction of
1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-3,3-dimethylbutan-1-one
1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-3,3-dimethylbutan-1-one
Compound characteristics
| Compound ID: | V025-3000 |
| Compound Name: | 1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]-3,3-dimethylbutan-1-one |
| Molecular Weight: | 456.63 |
| Molecular Formula: | C29 H36 N4 O |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2)c(nc(c2ccccc2)n1)N1CCCN(CC1)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9661 |
| logD: | 6.891 |
| logSw: | -5.7463 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.76 |
| InChI Key: | UXDBLKZBYSESQY-UHFFFAOYSA-N |