2-{[1-(4-chlorophenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methoxyethyl)-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
2-{[1-(4-chlorophenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methoxyethyl)-5-nitrobenzene-1-sulfonamide
2-{[1-(4-chlorophenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methoxyethyl)-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-7322 |
| Compound Name: | 2-{[1-(4-chlorophenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methoxyethyl)-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 580.02 |
| Molecular Formula: | C24 H26 Cl N5 O8 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(N2CCOCC2)=O)nn(c2ccc(cc2)[Cl])c1Oc1ccc(cc1S(NCCOC)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0481 |
| logD: | 3.048 |
| logSw: | -3.7165 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 129.352 |
| InChI Key: | DQAGDMNGXOMSQH-UHFFFAOYSA-N |