4-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid
4-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y040-8586 |
| Compound Name: | 4-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C24 H31 N3 O4 |
| Smiles: | C1C[C@H](CC[C@@H]1C(O)=O)CNC([C@@H]1CC[C@H](CC1)CN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4564 |
| logD: | -0.1039 |
| logSw: | -2.811 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.545 |
| InChI Key: | JLAIWEISRLXEKT-UHFFFAOYSA-N |