N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(4-ethoxyphenyl)-4-(methylsulfanyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(4-ethoxyphenyl)-4-(methylsulfanyl)benzene-1-sulfonamide
N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(4-ethoxyphenyl)-4-(methylsulfanyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3272-1058 |
| Compound Name: | N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(4-ethoxyphenyl)-4-(methylsulfanyl)benzene-1-sulfonamide |
| Molecular Weight: | 527.62 |
| Molecular Formula: | C25 H25 N3 O6 S2 |
| Smiles: | CCOc1ccc(cc1)N(CC(N/N=C/c1ccc2c(c1)OCO2)=O)S(c1ccc(cc1)SC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7971 |
| logD: | 4.797 |
| logSw: | -4.5108 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.405 |
| InChI Key: | OKBYQQVMQNMOBO-UHFFFAOYSA-N |