N-[2-(dimethylamino)ethyl]-5-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carboxamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-5-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carboxamide
N-[2-(dimethylamino)ethyl]-5-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V027-7557 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-5-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)furan-2-carboxamide |
| Molecular Weight: | 472.53 |
| Molecular Formula: | C20 H27 F3 N6 O2 S |
| Salt: | not_available |
| Smiles: | CN(C)CCNC(c1ccc(CSc2nc(cc(n2)N2CCN(C)CC2)C(F)(F)F)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9359 |
| logD: | 1.8096 |
| logSw: | -3.3674 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.886 |
| InChI Key: | FBVDEHNWAKVXGB-UHFFFAOYSA-N |