tert-butyl {[6-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-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-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxopropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
tert-butyl {[6-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxopropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
Compound characteristics
| Compound ID: | C908-0543 |
| Compound Name: | tert-butyl {[6-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-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: | Cc1c(CCC(NCCc2ccc(c(c2)OC)OC)=O)c(C)n2c(n1)nc(CNC(=O)OC(C)(C)C)n2 |
| Stereo: | ACHIRAL |
| logP: | 1.9652 |
| logD: | 1.965 |
| logSw: | -2.6163 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.544 |
| InChI Key: | ATYHEGBCVNJZGX-UHFFFAOYSA-N |