N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C096-0449 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 555.07 |
| Molecular Formula: | C23 H27 Cl N4 O6 S2 |
| Smiles: | CC1CCN(CC1)S(c1c2C(N(CC(Nc3cc(c(cc3OC)OC)[Cl])=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9712 |
| logD: | 2.9656 |
| logSw: | -3.7161 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.665 |
| InChI Key: | JIPQZURFQGYCCF-UHFFFAOYSA-N |