2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-(3-methylphenyl)-N-propylacetamide
Chemical Structure Depiction of
2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-(3-methylphenyl)-N-propylacetamide
2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-(3-methylphenyl)-N-propylacetamide
Compound characteristics
| Compound ID: | C210-0130 |
| Compound Name: | 2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-(3-methylphenyl)-N-propylacetamide |
| Molecular Weight: | 581.72 |
| Molecular Formula: | C27 H31 N7 O4 S2 |
| Smiles: | CCCN(C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(CC1)c1ncccn1)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1427 |
| logD: | 3.1427 |
| logSw: | -3.2824 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.92 |
| InChI Key: | UUZQKHLPLMCBKY-UHFFFAOYSA-N |