N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-leucine
Chemical Structure Depiction of
N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-leucine
N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-leucine
Compound characteristics
| Compound ID: | Y040-8579 |
| Compound Name: | N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-leucine |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C22 H29 N3 O4 |
| Smiles: | CC(C)C[C@@H](C(O)=O)NC([C@@H]1CC[C@H](CC1)CN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4556 |
| logD: | -2.1623 |
| logSw: | -2.123 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.254 |
| InChI Key: | MVJMLJLSYBIQBG-RJYAGPCLSA-N |