tert-butyl {[6-(3-anilino-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-anilino-3-oxopropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
tert-butyl {[6-(3-anilino-3-oxopropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
Compound characteristics
| Compound ID: | C908-0351 |
| Compound Name: | tert-butyl {[6-(3-anilino-3-oxopropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C22 H28 N6 O3 |
| Smiles: | Cc1c(CCC(Nc2ccccc2)=O)c(C)n2c(n1)nc(CNC(=O)OC(C)(C)C)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.7814 |
| logD: | 2.7812 |
| logSw: | -3.4642 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.12 |
| InChI Key: | QWUWNVKCDTUYCO-UHFFFAOYSA-N |