2-{[1-ethyl-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
2-{[1-ethyl-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide
2-{[1-ethyl-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V027-1572 |
| Compound Name: | 2-{[1-ethyl-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 481.53 |
| Molecular Formula: | C20 H27 N5 O7 S |
| Salt: | not_available |
| Smiles: | CCn1c(c(C)c(C(N2CCOCC2)=O)n1)Oc1ccc(cc1S(NC(C)C)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7399 |
| logD: | 1.7397 |
| logSw: | -2.656 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.216 |
| InChI Key: | AOQHEMVARQPISP-UHFFFAOYSA-N |