ethyl 5-(4-methylphenyl)-1-(4-oxo-4-{[(thiophen-2-yl)methyl]amino}butyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-methylphenyl)-1-(4-oxo-4-{[(thiophen-2-yl)methyl]amino}butyl)-1H-pyrrole-3-carboxylate
ethyl 5-(4-methylphenyl)-1-(4-oxo-4-{[(thiophen-2-yl)methyl]amino}butyl)-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | K906-3195 |
Compound Name: | ethyl 5-(4-methylphenyl)-1-(4-oxo-4-{[(thiophen-2-yl)methyl]amino}butyl)-1H-pyrrole-3-carboxylate |
Molecular Weight: | 410.53 |
Molecular Formula: | C23 H26 N2 O3 S |
Smiles: | CCOC(c1cc(c2ccc(C)cc2)n(CCCC(NCc2cccs2)=O)c1)=O |
Stereo: | ACHIRAL |
logP: | 4.5397 |
logD: | 4.5397 |
logSw: | -4.0502 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.671 |
InChI Key: | UBSYSYWKUIOWKC-UHFFFAOYSA-N |