2-butyl-8,9-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-butyl-8,9-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-butyl-8,9-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
Compound ID: | D472-0181 |
Compound Name: | 2-butyl-8,9-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
Molecular Weight: | 333.43 |
Molecular Formula: | C20 H23 N5 |
Smiles: | CCCCc1nc2c3c(C)c(C)n(c4ccc(C)cc4)c3ncn2n1 |
Stereo: | ACHIRAL |
logP: | 4.5213 |
logD: | 4.3774 |
logSw: | -4.5439 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 34.079 |
InChI Key: | MYZHZJNLZQXNTG-UHFFFAOYSA-N |