2-(2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)-1-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-(2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)-1-(morpholin-4-yl)ethan-1-one
2-(2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)-1-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | D347-0356 |
| Compound Name: | 2-(2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)-1-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | COc1cccc(c1)OCCSc1nc2ccccc2n1CC(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0985 |
| logD: | 3.0923 |
| logSw: | -3.2304 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.74 |
| InChI Key: | VBBREMBSHADQLU-UHFFFAOYSA-N |