N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-(4-bromophenoxy)acetamide
Chemical Structure Depiction of
N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-(4-bromophenoxy)acetamide
N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-(4-bromophenoxy)acetamide
Compound characteristics
| Compound ID: | 5609-1442 |
| Compound Name: | N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-(4-bromophenoxy)acetamide |
| Molecular Weight: | 423.31 |
| Molecular Formula: | C15 H11 Br N4 O2 S2 |
| Smiles: | C(C(NC(Nc1cccc2c1nsn2)=S)=O)Oc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.2224 |
| logD: | 4.2165 |
| logSw: | -4.4298 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.78 |
| InChI Key: | DSBHAVOXZMQVPY-UHFFFAOYSA-N |