N-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-alanine
Chemical Structure Depiction of
N-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-alanine
N-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-alanine
Compound characteristics
| Compound ID: | Y040-2783 |
| Compound Name: | N-{(1r,4S)-4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}-L-alanine |
| Molecular Weight: | 373.41 |
| Molecular Formula: | C19 H23 N3 O5 |
| Smiles: | C[C@@H](C(O)=O)NC([C@@H]1CC[C@H](CC1)CN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5114 |
| logD: | -2.1373 |
| logSw: | -2.1077 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.929 |
| InChI Key: | APPXEXAKZPGVKC-HIFPTAJRSA-N |