N-benzyl-N-(2-hydroxyethyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
Chemical Structure Depiction of
N-benzyl-N-(2-hydroxyethyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
N-benzyl-N-(2-hydroxyethyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide
Compound characteristics
| Compound ID: | D475-1609 |
| Compound Name: | N-benzyl-N-(2-hydroxyethyl)-2-[5-methyl-7-oxo-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl]acetamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C21 H21 N5 O3 S |
| Smiles: | CC1=CC(n2c(nc(c3cccs3)n2)N1CC(N(CCO)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1228 |
| logD: | 2.1228 |
| logSw: | -2.4353 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.953 |
| InChI Key: | IPKNXXOKUGPHKH-UHFFFAOYSA-N |