N-{3-[(4-ethylpiperazin-1-yl)(2-fluorophenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{3-[(4-ethylpiperazin-1-yl)(2-fluorophenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
N-{3-[(4-ethylpiperazin-1-yl)(2-fluorophenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | D411-0692 |
| Compound Name: | N-{3-[(4-ethylpiperazin-1-yl)(2-fluorophenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide |
| Molecular Weight: | 467.61 |
| Molecular Formula: | C26 H30 F N3 O2 S |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1F)c1c2CCCCc2sc1NC(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0723 |
| logD: | 4.4732 |
| logSw: | -4.5284 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.913 |
| InChI Key: | DUPHZINDDKLWSV-XMMPIXPASA-N |