4-[({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-[({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid
4-[({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y040-8652 |
| Compound Name: | 4-[({4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]cyclohexane-1-carbonyl}amino)methyl]cyclohexane-1-carboxylic acid |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C24 H31 N3 O5 |
| Smiles: | C1C[C@H](CC[C@@H]1C(O)=O)CNC([C@@H]1CC[C@H](CC1)CN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3089 |
| logD: | 0.7485 |
| logSw: | -3.5751 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.686 |
| InChI Key: | HMVYQOABRBKVBN-OPMHRUBESA-N |