2-(azepan-1-yl)-N-(3-ethoxypropyl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(azepan-1-yl)-N-(3-ethoxypropyl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
2-(azepan-1-yl)-N-(3-ethoxypropyl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F149-0575 |
| Compound Name: | 2-(azepan-1-yl)-N-(3-ethoxypropyl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C17 H25 N5 O3 S |
| Smiles: | CCOCCCNC(C1=CC(N=C2N1N=C(N1CCCCCC1)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7401 |
| logD: | 1.096 |
| logSw: | -2.1651 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.848 |
| InChI Key: | XGFQPHURVQSMOC-UHFFFAOYSA-N |