1-tert-butyl-5-[4-(3-chlorobenzamido)-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-tert-butyl-5-[4-(3-chlorobenzamido)-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid
1-tert-butyl-5-[4-(3-chlorobenzamido)-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V030-1810 |
| Compound Name: | 1-tert-butyl-5-[4-(3-chlorobenzamido)-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 577.06 |
| Molecular Formula: | C26 H29 Cl N4 O7 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(O)=O)nn(c1Oc1ccc(cc1S(N1CCOCC1)(=O)=O)NC(c1cccc(c1)[Cl])=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.6175 |
| logD: | 0.9045 |
| logSw: | -4.031 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.286 |
| InChI Key: | JYJGXPSCIGKNGM-UHFFFAOYSA-N |