5-[4-(4-fluoro-3-methylbenzamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[4-(4-fluoro-3-methylbenzamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid
5-[4-(4-fluoro-3-methylbenzamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V030-3527 |
| Compound Name: | 5-[4-(4-fluoro-3-methylbenzamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 637.69 |
| Molecular Formula: | C31 H32 F N5 O7 S |
| Salt: | not_available |
| Smiles: | Cc1cc(ccc1F)C(Nc1ccc(c(c1)S(NCCN1CCOCC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6747 |
| logD: | -0.8413 |
| logSw: | -4.059 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 126.19 |
| InChI Key: | KINFSLQJIQUCLP-UHFFFAOYSA-N |