N-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-(3-phenylprop-2-enamido)thieno[2,3-b]pyridine-2-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-(3-phenylprop-2-enamido)thieno[2,3-b]pyridine-2-carboxamide
N-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-(3-phenylprop-2-enamido)thieno[2,3-b]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | 8016-8633 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-(3-phenylprop-2-enamido)thieno[2,3-b]pyridine-2-carboxamide |
| Molecular Weight: | 476 |
| Molecular Formula: | C26 H22 Cl N3 O2 S |
| Smiles: | Cc1cc(C)nc2c1c(c(C(NCc1ccc(cc1)[Cl])=O)s2)NC(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7354 |
| logD: | 5.7311 |
| logSw: | -6.0694 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.661 |
| InChI Key: | DXFNQIZMCDLYBN-UHFFFAOYSA-N |