N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | C094-2118 |
| Compound Name: | N-{2-[(3-ethoxypropyl)amino]-1-(4-methylphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C27 H30 N2 O5 S |
| Smiles: | CCOCCCNC(C(c1ccc(C)cc1)N(Cc1cccs1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5079 |
| logD: | 4.5079 |
| logSw: | -4.2598 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.8 |
| InChI Key: | FCJYXODSOSEEHN-RUZDIDTESA-N |