N~3~-benzyl-N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N-(propan-2-yl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-benzyl-N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N-(propan-2-yl)-beta-alaninamide
N~3~-benzyl-N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N-(propan-2-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | V005-3076 |
| Compound Name: | N~3~-benzyl-N~3~-(7-chloro-2-ethylquinazolin-4-yl)-N-(propan-2-yl)-beta-alaninamide |
| Molecular Weight: | 410.95 |
| Molecular Formula: | C23 H27 Cl N4 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2ccc(cc2n1)[Cl])N(CCC(NC(C)C)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1117 |
| logD: | 4.3838 |
| logSw: | -5.408 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.887 |
| InChI Key: | XQGYFVJUHBLSIO-UHFFFAOYSA-N |