methyl 3-{[5-(3-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[5-(3-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}thiophene-2-carboxylate
methyl 3-{[5-(3-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | F694-0660 |
| Compound Name: | methyl 3-{[5-(3-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}thiophene-2-carboxylate |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C25 H26 N4 O4 S |
| Smiles: | Cc1cccc(c1)C(Nc1ccc(c(c1)NC(Nc1ccsc1C(=O)OC)=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9938 |
| logD: | 4.9924 |
| logSw: | -4.7265 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.947 |
| InChI Key: | VWVLQHUXMYDBFS-UHFFFAOYSA-N |