N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}pyridine-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}pyridine-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}pyridine-2-carboxamide
Compound characteristics
| Compound ID: | C094-2164 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}pyridine-2-carboxamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C28 H31 N3 O5 |
| Smiles: | CCOCCCNC(C(c1ccc(C)cc1)N(Cc1ccc2c(c1)OCO2)C(c1ccccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5938 |
| logD: | 3.5938 |
| logSw: | -3.5152 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.829 |
| InChI Key: | DYLOCWDUJHAGHB-AREMUKBSSA-N |