tert-butyl {[5,7-dimethyl-6-(3-{[(4-methylphenyl)methyl]amino}-3-oxopropyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
Chemical Structure Depiction of
tert-butyl {[5,7-dimethyl-6-(3-{[(4-methylphenyl)methyl]amino}-3-oxopropyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
tert-butyl {[5,7-dimethyl-6-(3-{[(4-methylphenyl)methyl]amino}-3-oxopropyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate
Compound characteristics
Compound ID: | C908-0354 |
Compound Name: | tert-butyl {[5,7-dimethyl-6-(3-{[(4-methylphenyl)methyl]amino}-3-oxopropyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}carbamate |
Molecular Weight: | 452.56 |
Molecular Formula: | C24 H32 N6 O3 |
Smiles: | Cc1ccc(CNC(CCc2c(C)nc3nc(CNC(=O)OC(C)(C)C)nn3c2C)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.0968 |
logD: | 3.0966 |
logSw: | -3.3412 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.442 |
InChI Key: | QIFXHTCMECVGBN-UHFFFAOYSA-N |