6-{[3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
6-{[3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y502-9993 |
| Compound Name: | 6-{[3-(methoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 323.37 |
| Molecular Formula: | C15 H17 N O5 S |
| Smiles: | Cc1cc(C(=O)OC)c(NC(C2CC=CCC2C(O)=O)=O)s1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4235 |
| logD: | 0.0677 |
| logSw: | -2.8867 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.898 |
| InChI Key: | CWEWJVAOJXHPCU-UHFFFAOYSA-N |