N-{[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamothioyl}-4-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-{[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamothioyl}-4-(pyrrolidine-1-sulfonyl)benzamide
N-{[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamothioyl}-4-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 3339-4537 |
| Compound Name: | N-{[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamothioyl}-4-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 598.5 |
| Molecular Formula: | C21 H19 I N4 O3 S3 |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)C(NC(Nc1nc(cs1)c1ccc(cc1)I)=S)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9899 |
| logD: | 5.9896 |
| logSw: | -5.9326 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.091 |
| InChI Key: | UWRMXGMXDFMYAF-UHFFFAOYSA-N |