4-tert-butyl-N-{2-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{2-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
4-tert-butyl-N-{2-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Compound characteristics
| Compound ID: | 8009-0417 |
| Compound Name: | 4-tert-butyl-N-{2-[(2-{[2-(4-chlorophenoxy)ethyl]amino}-2-oxoethyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide |
| Molecular Weight: | 554.13 |
| Molecular Formula: | C28 H28 Cl N3 O3 S2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCC(NCCOc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4435 |
| logD: | 7.4428 |
| logSw: | -6.457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.87 |
| InChI Key: | MVBWDJQZESJFER-UHFFFAOYSA-N |