methyl 4-{2-[(6-{[(2-hydroxy-5-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(6-{[(2-hydroxy-5-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate
methyl 4-{2-[(6-{[(2-hydroxy-5-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8007-7485 |
| Compound Name: | methyl 4-{2-[(6-{[(2-hydroxy-5-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 603.46 |
| Molecular Formula: | C24 H18 I N3 O4 S2 |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nc2ccc(cc2s1)/N=C/c1cc(ccc1O)I)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8055 |
| logD: | 6.7335 |
| logSw: | -5.4456 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.047 |
| InChI Key: | RBAOVQXYQWNTCM-UHFFFAOYSA-N |