6-({4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-({4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
6-({4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | 6049-1372 |
| Compound Name: | 6-({4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}carbamoyl)cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C19 H20 N4 O5 S |
| Smiles: | Cc1ccnc(NS(c2ccc(cc2)NC(C2CC=CCC2C(O)=O)=O)(=O)=O)n1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.4176 |
| logD: | -0.9382 |
| logSw: | -2.7094 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.523 |
| InChI Key: | SQHFGAIYNPNRJI-UHFFFAOYSA-N |