4-({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)butanoic acid
Chemical Structure Depiction of
4-({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)butanoic acid
4-({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)butanoic acid
Compound characteristics
| Compound ID: | Y042-8869 |
| Compound Name: | 4-({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)butanoic acid |
| Molecular Weight: | 387.43 |
| Molecular Formula: | C20 H25 N3 O5 |
| Smiles: | C(CC(O)=O)CNC([C@@H]1CC[C@H](CC1)CN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9155 |
| logD: | -0.9053 |
| logSw: | -2.6774 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.583 |
| InChI Key: | AIRVSLKMAFLAIP-UHFFFAOYSA-N |