3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V027-7553 |
| Compound Name: | 3-({[4-ethyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1cccc(c1)C(NCCOC)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.9819 |
| logD: | 3.9815 |
| logSw: | -3.9187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.906 |
| InChI Key: | DJLRTGYBWCFURK-UHFFFAOYSA-N |