{5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidin-6-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidin-6-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone
{5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidin-6-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | K895-0281 |
| Compound Name: | {5-methyl-4-[methyl(phenyl)amino]thieno[2,3-d]pyrimidin-6-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 488.57 |
| Molecular Formula: | C25 H24 N6 O3 S |
| Smiles: | Cc1c2c(ncnc2sc1C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)N(C)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6582 |
| logD: | 4.6276 |
| logSw: | -4.5677 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.549 |
| InChI Key: | CTGQLNWRIVQRCA-UHFFFAOYSA-N |