N-(5-methyl-3-{(4-methylpiperazin-1-yl)[4-(methylsulfanyl)phenyl]methyl}thiophen-2-yl)furan-2-carboxamide
Chemical Structure Depiction of
N-(5-methyl-3-{(4-methylpiperazin-1-yl)[4-(methylsulfanyl)phenyl]methyl}thiophen-2-yl)furan-2-carboxamide
N-(5-methyl-3-{(4-methylpiperazin-1-yl)[4-(methylsulfanyl)phenyl]methyl}thiophen-2-yl)furan-2-carboxamide
Compound characteristics
Compound ID: | D411-0513 |
Compound Name: | N-(5-methyl-3-{(4-methylpiperazin-1-yl)[4-(methylsulfanyl)phenyl]methyl}thiophen-2-yl)furan-2-carboxamide |
Molecular Weight: | 441.61 |
Molecular Formula: | C23 H27 N3 O2 S2 |
Smiles: | Cc1cc(C(c2ccc(cc2)SC)N2CCN(C)CC2)c(NC(c2ccco2)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5466 |
logD: | 4.0731 |
logSw: | -4.2148 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.932 |
InChI Key: | PQLMGVZAHPSISD-OAQYLSRUSA-N |