ethyl 4-({[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}carbamamido)benzoate
Chemical Structure Depiction of
ethyl 4-({[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}carbamamido)benzoate
ethyl 4-({[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | L585-0616 |
| Compound Name: | ethyl 4-({[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}carbamamido)benzoate |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C20 H24 N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(NCc1ccnc(c1)N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4778 |
| logD: | 3.387 |
| logSw: | -3.7546 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.581 |
| InChI Key: | OJLGARDAMZXAML-UHFFFAOYSA-N |