N-{3-[(4-ethylpiperazin-1-yl)(phenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{3-[(4-ethylpiperazin-1-yl)(phenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
N-{3-[(4-ethylpiperazin-1-yl)(phenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | D411-0683 |
| Compound Name: | N-{3-[(4-ethylpiperazin-1-yl)(phenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C26 H31 N3 O2 S |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1)c1c2CCCCc2sc1NC(c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.89 |
| logD: | 3.9646 |
| logSw: | -4.4519 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.913 |
| InChI Key: | MBRQRANUHUQHGG-XMMPIXPASA-N |