methyl N-{[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}glycinate
Chemical Structure Depiction of
methyl N-{[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}glycinate
methyl N-{[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}glycinate
Compound characteristics
| Compound ID: | C096-0522 |
| Compound Name: | methyl N-{[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetyl}glycinate |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C18 H24 N4 O6 S2 |
| Smiles: | CC1CCN(CC1)S(c1c2C(N(CC(NCC(=O)OC)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5475 |
| logD: | 0.5475 |
| logSw: | -1.8162 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.274 |
| InChI Key: | BPNPGWOWBVINBS-UHFFFAOYSA-N |