N-(butan-2-yl)-N~3~-(7-chloro-2-cyclopropylquinazolin-4-yl)-N~3~-(2-phenylethyl)-beta-alaninamide
Chemical Structure Depiction of
N-(butan-2-yl)-N~3~-(7-chloro-2-cyclopropylquinazolin-4-yl)-N~3~-(2-phenylethyl)-beta-alaninamide
N-(butan-2-yl)-N~3~-(7-chloro-2-cyclopropylquinazolin-4-yl)-N~3~-(2-phenylethyl)-beta-alaninamide
Compound characteristics
| Compound ID: | V009-5070 |
| Compound Name: | N-(butan-2-yl)-N~3~-(7-chloro-2-cyclopropylquinazolin-4-yl)-N~3~-(2-phenylethyl)-beta-alaninamide |
| Molecular Weight: | 451.01 |
| Molecular Formula: | C26 H31 Cl N4 O |
| Salt: | not_available |
| Smiles: | CCC(C)NC(CCN(CCc1ccccc1)c1c2ccc(cc2nc(C2CC2)n1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2831 |
| logD: | 4.178 |
| logSw: | -6.0574 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.594 |
| InChI Key: | IXMBSRYKBUITJV-SFHVURJKSA-N |