(4-ethylphenyl){4-[6-methyl-2-phenyl-5-(propan-2-yl)pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(4-ethylphenyl){4-[6-methyl-2-phenyl-5-(propan-2-yl)pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
(4-ethylphenyl){4-[6-methyl-2-phenyl-5-(propan-2-yl)pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V014-8595 |
| Compound Name: | (4-ethylphenyl){4-[6-methyl-2-phenyl-5-(propan-2-yl)pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 442.6 |
| Molecular Formula: | C28 H34 N4 O |
| Salt: | not_available |
| Smiles: | CCc1ccc(cc1)C(N1CCCN(CC1)c1c(C(C)C)c(C)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7597 |
| logD: | 6.6662 |
| logSw: | -5.7244 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.288 |
| InChI Key: | ZKLFURDMZQGPIY-UHFFFAOYSA-N |