1-(3-fluorophenyl)-4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(3-fluorophenyl)-4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid
1-(3-fluorophenyl)-4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-2566 |
| Compound Name: | 1-(3-fluorophenyl)-4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 560.6 |
| Molecular Formula: | C26 H29 F N4 O7 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(Nc1ccc(c(c1)S(N1CCOCC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3055 |
| logD: | -1.2105 |
| logSw: | -3.6417 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.591 |
| InChI Key: | BHANLUMIUAFGHL-INIZCTEOSA-N |