N-{3-[(2H-1,3-benzodioxol-5-yl)(4-methylpiperazin-1-yl)methyl]-5-ethylthiophen-2-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{3-[(2H-1,3-benzodioxol-5-yl)(4-methylpiperazin-1-yl)methyl]-5-ethylthiophen-2-yl}furan-2-carboxamide
N-{3-[(2H-1,3-benzodioxol-5-yl)(4-methylpiperazin-1-yl)methyl]-5-ethylthiophen-2-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | D411-0551 |
| Compound Name: | N-{3-[(2H-1,3-benzodioxol-5-yl)(4-methylpiperazin-1-yl)methyl]-5-ethylthiophen-2-yl}furan-2-carboxamide |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C24 H27 N3 O4 S |
| Smiles: | CCc1cc(C(c2ccc3c(c2)OCO3)N2CCN(C)CC2)c(NC(c2ccco2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1232 |
| logD: | 1.9809 |
| logSw: | -4.0769 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.048 |
| InChI Key: | IIEDLKKOCJMXJK-JOCHJYFZSA-N |