methyl 6-{2-[4-(dimethylamino)anilino]-2-oxoethyl}-6H-thieno[2,3-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 6-{2-[4-(dimethylamino)anilino]-2-oxoethyl}-6H-thieno[2,3-b]pyrrole-5-carboxylate
methyl 6-{2-[4-(dimethylamino)anilino]-2-oxoethyl}-6H-thieno[2,3-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C777-0692 |
| Compound Name: | methyl 6-{2-[4-(dimethylamino)anilino]-2-oxoethyl}-6H-thieno[2,3-b]pyrrole-5-carboxylate |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C18 H19 N3 O3 S |
| Smiles: | CN(C)c1ccc(cc1)NC(Cn1c(cc2ccsc12)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3801 |
| logD: | 3.3716 |
| logSw: | -3.7377 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.674 |
| InChI Key: | NAUBTAFAWGFHBI-UHFFFAOYSA-N |