2-{[4-(4-methoxy-3-nitrophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}benzoic acid
Chemical Structure Depiction of
2-{[4-(4-methoxy-3-nitrophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}benzoic acid
2-{[4-(4-methoxy-3-nitrophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}benzoic acid
Compound characteristics
| Compound ID: | 8007-7109 |
| Compound Name: | 2-{[4-(4-methoxy-3-nitrophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}benzoic acid |
| Molecular Weight: | 413.41 |
| Molecular Formula: | C19 H15 N3 O6 S |
| Smiles: | Cc1c(c2ccc(c(c2)[N+]([O-])=O)OC)nc(NC(c2ccccc2C(O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3716 |
| logD: | -1.0712 |
| logSw: | -3.8309 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.994 |
| InChI Key: | LTUBGGKPJKRTNX-UHFFFAOYSA-N |