7-chloro-N-(2-cyanoethyl)-N-phenyl-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-(2-cyanoethyl)-N-phenyl-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-(2-cyanoethyl)-N-phenyl-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0421 |
| Compound Name: | 7-chloro-N-(2-cyanoethyl)-N-phenyl-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 410.94 |
| Molecular Formula: | C21 H15 Cl N2 O S2 |
| Smiles: | C(CN(C(c1cc2CSc3cc(ccc3c2s1)[Cl])=O)c1ccccc1)C#N |
| Stereo: | ACHIRAL |
| logP: | 5.1448 |
| logD: | 5.1448 |
| logSw: | -5.4017 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.999 |
| InChI Key: | OGVDSNKFXONUNG-UHFFFAOYSA-N |