1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid
1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V030-1741 |
| Compound Name: | 1-tert-butyl-4-methyl-5-[4-(2-methylpropanamido)-2-(morpholine-4-sulfonyl)phenoxy]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 508.59 |
| Molecular Formula: | C23 H32 N4 O7 S |
| Salt: | not_available |
| Smiles: | CC(C)C(Nc1ccc(c(c1)S(N1CCOCC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2949 |
| logD: | -0.418 |
| logSw: | -2.9411 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.558 |
| InChI Key: | PNHFQCRSDGANTM-UHFFFAOYSA-N |