N-[4-(diethylamino)-2-methylphenyl]-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-(diethylamino)-2-methylphenyl]-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
N-[4-(diethylamino)-2-methylphenyl]-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M179-0036 |
| Compound Name: | N-[4-(diethylamino)-2-methylphenyl]-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 399.56 |
| Molecular Formula: | C21 H29 N5 O S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(CSc1cc(ncn1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1802 |
| logD: | 3.9709 |
| logSw: | -4.0754 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.607 |
| InChI Key: | WECDXGJYLLDMAA-UHFFFAOYSA-N |