1-(4-methoxyphenyl)-5-{2-[(3-methoxypropyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(4-methoxyphenyl)-5-{2-[(3-methoxypropyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
1-(4-methoxyphenyl)-5-{2-[(3-methoxypropyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V030-3589 |
| Compound Name: | 1-(4-methoxyphenyl)-5-{2-[(3-methoxypropyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 574.65 |
| Molecular Formula: | C27 H34 N4 O8 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(c1)S(NCCCOC)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6958 |
| logD: | -0.8202 |
| logSw: | -4.0682 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 130.515 |
| InChI Key: | DQBPDJIQXRPEPQ-UHFFFAOYSA-N |