N-{3-[ethyl(3-methylphenyl)amino]propyl}-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C909-0341 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-5,5-dioxo-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 454.61 |
| Molecular Formula: | C24 H26 N2 O3 S2 |
| Smiles: | CCN(CCCNC(c1cc2CS(c3ccccc3c2s1)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6263 |
| logD: | 4.5979 |
| logSw: | -4.208 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.676 |
| InChI Key: | OCDHTMSJSWGXCA-UHFFFAOYSA-N |