N-{3-[benzyl(ethyl)amino]propyl}-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-{3-[benzyl(ethyl)amino]propyl}-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
N-{3-[benzyl(ethyl)amino]propyl}-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C096-0532 |
| Compound Name: | N-{3-[benzyl(ethyl)amino]propyl}-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 559.75 |
| Molecular Formula: | C27 H37 N5 O4 S2 |
| Smiles: | CCN(CCCNC(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCC(C)CC1)(=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4392 |
| logD: | 0.7923 |
| logSw: | -2.7494 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.952 |
| InChI Key: | BGATUDFFBVJSHS-UHFFFAOYSA-N |