6-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
6-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y206-3512 |
| Compound Name: | 6-{[3-(1H-imidazol-1-yl)propyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 305.38 |
| Molecular Formula: | C16 H23 N3 O3 |
| Smiles: | CC1CC(C(CC=1C)C(NCCCn1ccnc1)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.4566 |
| logD: | -1.8992 |
| logSw: | -1.5212 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.894 |
| InChI Key: | WCWGDJNDACBHMG-UHFFFAOYSA-N |