N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-tyrosine
Chemical Structure Depiction of
N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-tyrosine
N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-tyrosine
Compound characteristics
| Compound ID: | Y040-8585 |
| Compound Name: | N-{(1r,4S)-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}-L-tyrosine |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C25 H27 N3 O5 |
| Smiles: | C1C[C@@H](CC[C@H]1CN1C=Nc2ccccc2C1=O)C(N[C@@H](Cc1ccc(cc1)O)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1228 |
| logD: | -2.4678 |
| logSw: | -2.087 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.6 |
| InChI Key: | SGGNUWMCYCOYSD-IRZJEQJZSA-N |