N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | D336-4617 |
| Compound Name: | N-(2-{[2-(2-methoxy-4-methylphenoxy)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 450.58 |
| Molecular Formula: | C24 H22 N2 O3 S2 |
| Smiles: | Cc1ccc(c(c1)OC)OCCSc1nc2ccc(cc2s1)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5828 |
| logD: | 5.5822 |
| logSw: | -5.3895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.274 |
| InChI Key: | OCMDBVJUJFVEJD-UHFFFAOYSA-N |