5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6183 |
| Compound Name: | 5-{[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C14 H12 N4 O5 S2 |
| Smiles: | Cn1c(C(Nc2nc3ccc(cc3s2)S(C)(=O)=O)=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0511 |
| logD: | -3.1377 |
| logSw: | -2.394 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.764 |
| InChI Key: | YHWDHGPJKFCPNB-UHFFFAOYSA-N |