N-[(1,3-benzothiazol-2-yl)carbamothioyl]-4-methylbenzamide
Chemical Structure Depiction of
N-[(1,3-benzothiazol-2-yl)carbamothioyl]-4-methylbenzamide
N-[(1,3-benzothiazol-2-yl)carbamothioyl]-4-methylbenzamide
Compound characteristics
| Compound ID: | 3820-2569 |
| Compound Name: | N-[(1,3-benzothiazol-2-yl)carbamothioyl]-4-methylbenzamide |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C16 H13 N3 O S2 |
| Smiles: | Cc1ccc(cc1)C(NC(Nc1nc2ccccc2s1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6878 |
| logD: | 4.6871 |
| logSw: | -4.4482 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.001 |
| InChI Key: | VBJVBDPIAKFNNN-UHFFFAOYSA-N |