N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-4-ethoxybenzamide
Chemical Structure Depiction of
N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-4-ethoxybenzamide
N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-4-ethoxybenzamide
Compound characteristics
| Compound ID: | C301-0502 |
| Compound Name: | N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-4-ethoxybenzamide |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C16 H14 N4 O2 S2 |
| Smiles: | CCOc1ccc(cc1)C(NC(Nc1cccc2c1nsn2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0443 |
| logD: | 4.0437 |
| logSw: | -4.009 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.618 |
| InChI Key: | IDHVHORWQXBOGX-UHFFFAOYSA-N |