1-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-proline
Chemical Structure Depiction of
1-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-proline
1-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-proline
Compound characteristics
| Compound ID: | Y042-2771 |
| Compound Name: | 1-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-proline |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C21 H25 N3 O5 |
| Smiles: | C1C[C@@H](C(O)=O)N(C1)C([C@H]1CC[C@@H](CC1)CN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8891 |
| logD: | -1.8129 |
| logSw: | -2.6855 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.789 |
| InChI Key: | UWACIRVCEMTNJJ-KVULBXGLSA-N |