1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
Compound characteristics
| Compound ID: | V026-0031 |
| Compound Name: | 1-[4-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one |
| Molecular Weight: | 414.55 |
| Molecular Formula: | C26 H30 N4 O |
| Salt: | not_available |
| Smiles: | CCC(N1CCCN(CC1)c1c(Cc2ccccc2)c(C)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7014 |
| logD: | 5.6263 |
| logSw: | -5.3807 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.76 |
| InChI Key: | WMTZTDUHYSKZIW-UHFFFAOYSA-N |