2-(4-bromophenyl)-2-oxoethyl ({2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)acetate
Chemical Structure Depiction of
2-(4-bromophenyl)-2-oxoethyl ({2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)acetate
2-(4-bromophenyl)-2-oxoethyl ({2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)acetate
Compound characteristics
| Compound ID: | 8006-2672 |
| Compound Name: | 2-(4-bromophenyl)-2-oxoethyl ({2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)acetate |
| Molecular Weight: | 493.4 |
| Molecular Formula: | C20 H17 Br N2 O4 S2 |
| Smiles: | Cc1ccc2c(c1)sc(NC(CSCC(=O)OCC(c1ccc(cc1)[Br])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.0584 |
| logD: | 5.0584 |
| logSw: | -4.7147 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.659 |
| InChI Key: | LBIRYDZOCOFCRU-UHFFFAOYSA-N |