2-{[(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}-4-chlorophenol
Chemical Structure Depiction of
2-{[(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}-4-chlorophenol
2-{[(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}-4-chlorophenol
Compound characteristics
| Compound ID: | 8007-0402 |
| Compound Name: | 2-{[(2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)imino]methyl}-4-chlorophenol |
| Molecular Weight: | 467.05 |
| Molecular Formula: | C25 H23 Cl N2 O S2 |
| Smiles: | CC(C)(C)c1ccc(CSc2nc3ccc(cc3s2)/N=C/c2cc(ccc2O)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 8.029 |
| logD: | 7.9594 |
| logSw: | -6.3753 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.724 |
| InChI Key: | HPQZDVOHNIEBEZ-UHFFFAOYSA-N |