1-benzyl-N-[(4-iodophenyl)carbamothioyl]-2,3-dimethyl-1H-indole-5-carboxamide
Chemical Structure Depiction of
1-benzyl-N-[(4-iodophenyl)carbamothioyl]-2,3-dimethyl-1H-indole-5-carboxamide
1-benzyl-N-[(4-iodophenyl)carbamothioyl]-2,3-dimethyl-1H-indole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-0113 |
| Compound Name: | 1-benzyl-N-[(4-iodophenyl)carbamothioyl]-2,3-dimethyl-1H-indole-5-carboxamide |
| Molecular Weight: | 539.44 |
| Molecular Formula: | C25 H22 I N3 O S |
| Smiles: | Cc1c2cc(ccc2n(Cc2ccccc2)c1C)C(NC(Nc1ccc(cc1)I)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1798 |
| logD: | 7.1797 |
| logSw: | -5.6622 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 34.44 |
| InChI Key: | ZBCHMTRXETUZBM-UHFFFAOYSA-N |