methyl 2-{2-[(6-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[(6-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate
methyl 2-{2-[(6-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8009-4800 |
| Compound Name: | methyl 2-{2-[(6-{[(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 546.45 |
| Molecular Formula: | C24 H17 Cl2 N3 O4 S2 |
| Smiles: | COC(c1ccccc1NC(CSc1nc2ccc(cc2s1)/N=C/c1cc(cc(c1O)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3487 |
| logD: | 5.769 |
| logSw: | -5.6259 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.28 |
| InChI Key: | LQWVRASBDXZOTP-UHFFFAOYSA-N |