3-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
3-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y206-4492 |
| Compound Name: | 3-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}bicyclo[2.2.2]oct-5-ene-2-carboxylic acid |
| Molecular Weight: | 303.36 |
| Molecular Formula: | C16 H21 N3 O3 |
| Smiles: | C(CNC(C1C2CCC(C=C2)C1C(O)=O)=O)Cn1ccnc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.4033 |
| logD: | -1.9219 |
| logSw: | -1.0057 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.815 |
| InChI Key: | YQFSMMHEUONBBL-UHFFFAOYSA-N |