2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]acetamide
Chemical Structure Depiction of
2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]acetamide
2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]acetamide
Compound characteristics
| Compound ID: | 8008-1815 |
| Compound Name: | 2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]acetamide |
| Molecular Weight: | 632.58 |
| Molecular Formula: | C24 H17 I N4 O S4 |
| Smiles: | CSc1nc2ccc(cc2s1)NC(CSc1nc2ccc(cc2s1)/N=C/c1ccc(cc1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 7.726 |
| logD: | 7.7256 |
| logSw: | -5.6276 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.407 |
| InChI Key: | XBHDIQDFKALXHT-UHFFFAOYSA-N |