methyl [6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Chemical Structure Depiction of
methyl [6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate
methyl [6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Compound characteristics
| Compound ID: | C066-0926 |
| Compound Name: | methyl [6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C16 H21 N3 O5 S2 |
| Smiles: | CC1CCN(CC1)S(c1c2C(N(CC(=O)OC)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1778 |
| logD: | 1.1778 |
| logSw: | -1.6975 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.803 |
| InChI Key: | YFDAKXZLNSAINL-UHFFFAOYSA-N |