4-{[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-{[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
4-{[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]methyl}cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y043-1543 |
| Compound Name: | 4-{[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamido]methyl}cyclohexane-1-carboxylic acid |
| Molecular Weight: | 347.41 |
| Molecular Formula: | C18 H25 N3 O4 |
| Smiles: | C1CCC2C(C1)=CC(N(CC(NC[C@H]1CC[C@@H](CC1)C(O)=O)=O)N=2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7973 |
| logD: | -1.763 |
| logSw: | -1.2155 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.305 |
| InChI Key: | ODNIWSGGMYTLTF-UHFFFAOYSA-N |