N-benzyl-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-methylbutanamide
Chemical Structure Depiction of
N-benzyl-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-methylbutanamide
N-benzyl-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-methylbutanamide
Compound characteristics
| Compound ID: | E596-0318 |
| Compound Name: | N-benzyl-4-[4-(3-methoxypropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]-N-methylbutanamide |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C23 H27 N5 O3 S |
| Smiles: | CN(Cc1ccccc1)C(CCCc1nnc2N(CCCOC)C(c3c(ccs3)n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6305 |
| logD: | 2.6305 |
| logSw: | -2.8526 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.212 |
| InChI Key: | CGGVAVUFGAWOHD-UHFFFAOYSA-N |