4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V007-7727 |
| Compound Name: | 4-methyl-5-[4-(2-methylbutanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 556.64 |
| Molecular Formula: | C27 H32 N4 O7 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(Nc1ccc(c(c1)S(N1CCOCC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6585 |
| logD: | -0.8575 |
| logSw: | -3.7977 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.591 |
| InChI Key: | FVBPIKPEJLZFBE-SFHVURJKSA-N |