5-[4-(2-ethylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[4-(2-ethylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
5-[4-(2-ethylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-7647 |
| Compound Name: | 5-[4-(2-ethylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1-(4-methoxyphenyl)-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 629.73 |
| Molecular Formula: | C30 H39 N5 O8 S |
| Salt: | not_available |
| Smiles: | CCC(CC)C(Nc1ccc(c(c1)S(NCCN1CCOCC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3108 |
| logD: | -1.2052 |
| logSw: | -3.6239 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 134.006 |
| InChI Key: | GLEXPMNPTCXHGK-UHFFFAOYSA-N |