2-(azepan-1-yl)-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-(azepan-1-yl)-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
2-(azepan-1-yl)-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | C796-0858 |
| Compound Name: | 2-(azepan-1-yl)-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C20 H30 N6 O2 S |
| Smiles: | CC1CCN(CC1)CCNC(C1=CN=C2N(C1=O)N=C(N1CCCCCC1)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1267 |
| logD: | 0.3482 |
| logSw: | -2.438 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.395 |
| InChI Key: | HMQAFCSXPKWUFF-UHFFFAOYSA-N |