N-{3-[(3-chlorophenyl)(4-ethylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{3-[(3-chlorophenyl)(4-ethylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
N-{3-[(3-chlorophenyl)(4-ethylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Compound characteristics
Compound ID: | D411-0688 |
Compound Name: | N-{3-[(3-chlorophenyl)(4-ethylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide |
Molecular Weight: | 484.06 |
Molecular Formula: | C26 H30 Cl N3 O2 S |
Smiles: | CCN1CCN(CC1)C(c1cccc(c1)[Cl])c1c2CCCCc2sc1NC(c1ccco1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.4886 |
logD: | 4.8686 |
logSw: | -5.7925 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.913 |
InChI Key: | YZFVJYRRPKRNJN-XMMPIXPASA-N |