5-{4-[(cyclopentanecarbonyl)amino]-2-(morpholine-4-sulfonyl)phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-{4-[(cyclopentanecarbonyl)amino]-2-(morpholine-4-sulfonyl)phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
5-{4-[(cyclopentanecarbonyl)amino]-2-(morpholine-4-sulfonyl)phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-3894 |
| Compound Name: | 5-{4-[(cyclopentanecarbonyl)amino]-2-(morpholine-4-sulfonyl)phenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 582.68 |
| Molecular Formula: | C29 H34 N4 O7 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1C)n1c(c(C)c(C(O)=O)n1)Oc1ccc(cc1S(N1CCOCC1)(=O)=O)NC(C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1714 |
| logD: | -0.3446 |
| logSw: | -4.2088 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.576 |
| InChI Key: | JHBMZZBIRNRMER-UHFFFAOYSA-N |