2-{[1-(4-chlorophenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-cyclopropyl-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
2-{[1-(4-chlorophenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-cyclopropyl-5-nitrobenzene-1-sulfonamide
2-{[1-(4-chlorophenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-cyclopropyl-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-2472 |
| Compound Name: | 2-{[1-(4-chlorophenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-cyclopropyl-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 546 |
| Molecular Formula: | C24 H24 Cl N5 O6 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(N2CCCC2)=O)nn(c2ccc(cc2)[Cl])c1Oc1ccc(cc1S(NC1CC1)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3268 |
| logD: | 4.3266 |
| logSw: | -4.7622 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.624 |
| InChI Key: | SMKVKLRTNXVHIO-UHFFFAOYSA-N |