5-[4-(3-fluorobenzamido)-2-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenoxy]-1-(3-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[4-(3-fluorobenzamido)-2-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenoxy]-1-(3-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
5-[4-(3-fluorobenzamido)-2-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenoxy]-1-(3-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V027-3625 |
| Compound Name: | 5-[4-(3-fluorobenzamido)-2-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenoxy]-1-(3-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 655.68 |
| Molecular Formula: | C31 H31 F2 N5 O7 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(O)=O)nn(c2cccc(c2)F)c1Oc1ccc(cc1S(NCCCN1CCOCC1)(=O)=O)NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6116 |
| logD: | -0.9044 |
| logSw: | -3.8967 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 126.19 |
| InChI Key: | LKLKYLFZKCAHJZ-UHFFFAOYSA-N |