tert-butyl ({6-[3-(2,5-diethoxyanilino)-3-oxopropyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)carbamate
Chemical Structure Depiction of
tert-butyl ({6-[3-(2,5-diethoxyanilino)-3-oxopropyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)carbamate
tert-butyl ({6-[3-(2,5-diethoxyanilino)-3-oxopropyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)carbamate
Compound characteristics
| Compound ID: | C908-0478 |
| Compound Name: | tert-butyl ({6-[3-(2,5-diethoxyanilino)-3-oxopropyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}methyl)carbamate |
| Molecular Weight: | 512.61 |
| Molecular Formula: | C26 H36 N6 O5 |
| Smiles: | CCOc1ccc(c(c1)NC(CCc1c(C)nc2nc(CNC(=O)OC(C)(C)C)nn2c1C)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.4656 |
| logD: | 3.4642 |
| logSw: | -3.7838 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.756 |
| InChI Key: | MDVLEWXYRNZBCR-UHFFFAOYSA-N |