N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{1-(4-chlorophenyl)-2-[(3-ethoxypropyl)amino]-2-oxoethyl}pyrazine-2-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{1-(4-chlorophenyl)-2-[(3-ethoxypropyl)amino]-2-oxoethyl}pyrazine-2-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{1-(4-chlorophenyl)-2-[(3-ethoxypropyl)amino]-2-oxoethyl}pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | C094-2185 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{1-(4-chlorophenyl)-2-[(3-ethoxypropyl)amino]-2-oxoethyl}pyrazine-2-carboxamide |
| Molecular Weight: | 510.98 |
| Molecular Formula: | C26 H27 Cl N4 O5 |
| Smiles: | CCOCCCNC(C(c1ccc(cc1)[Cl])N(Cc1ccc2c(c1)OCO2)C(c1cnccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9773 |
| logD: | 2.9773 |
| logSw: | -3.6912 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.347 |
| InChI Key: | SLWZMWHAYMCWHI-XMMPIXPASA-N |