N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-(4-ethoxyphenyl)-N~2~-[4-(methylsulfanyl)benzene-1-sulfonyl]glycinamide
Chemical Structure Depiction of
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-(4-ethoxyphenyl)-N~2~-[4-(methylsulfanyl)benzene-1-sulfonyl]glycinamide
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-(4-ethoxyphenyl)-N~2~-[4-(methylsulfanyl)benzene-1-sulfonyl]glycinamide
Compound characteristics
| Compound ID: | 5261-1284 |
| Compound Name: | N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-(4-ethoxyphenyl)-N~2~-[4-(methylsulfanyl)benzene-1-sulfonyl]glycinamide |
| Molecular Weight: | 566.7 |
| Molecular Formula: | C28 H30 N4 O5 S2 |
| Smiles: | CCOc1ccc(cc1)N(CC(NC1=C(C)N(C)N(C1=O)c1ccccc1)=O)S(c1ccc(cc1)SC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7164 |
| logD: | 3.6753 |
| logSw: | -3.8244 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.447 |
| InChI Key: | RQRLCPMPJRXGRF-UHFFFAOYSA-N |