N-butyl-2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-butyl-2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-butyl-2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8007-6638 |
| Compound Name: | N-butyl-2-[(6-{[(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 509.43 |
| Molecular Formula: | C20 H20 I N3 O S2 |
| Smiles: | CCCCNC(CSc1nc2ccc(cc2s1)/N=C/c1ccc(cc1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8014 |
| logD: | 5.801 |
| logSw: | -5.3738 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.76 |
| InChI Key: | XOTJDZBZICEQCN-UHFFFAOYSA-N |