N-{2-[(3-ethoxypropyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[(3-ethoxypropyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
N-{2-[(3-ethoxypropyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | C094-2135 |
| Compound Name: | N-{2-[(3-ethoxypropyl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-N-[(thiophen-2-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 510.61 |
| Molecular Formula: | C27 H30 N2 O6 S |
| Smiles: | CCOCCCNC(C(c1ccc(cc1)OC)N(Cc1cccs1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0669 |
| logD: | 4.0669 |
| logSw: | -4.0958 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.343 |
| InChI Key: | QDAVBJYMRFEGGV-RUZDIDTESA-N |