1-(4-methoxyphenyl)-4-methyl-5-[4-(3-methylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(4-methoxyphenyl)-4-methyl-5-[4-(3-methylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1H-pyrazole-3-carboxylic acid
1-(4-methoxyphenyl)-4-methyl-5-[4-(3-methylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-7646 |
| Compound Name: | 1-(4-methoxyphenyl)-4-methyl-5-[4-(3-methylbutanamido)-2-{[2-(morpholin-4-yl)ethyl]sulfamoyl}phenoxy]-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 615.71 |
| Molecular Formula: | C29 H37 N5 O8 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(c1)S(NCCN1CCOCC1)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1205 |
| logD: | -1.3955 |
| logSw: | -3.5316 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 133.792 |
| InChI Key: | KLUXNDHDKFSHON-UHFFFAOYSA-N |