1-{4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one
Chemical Structure Depiction of
1-{4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one
1-{4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one
Compound characteristics
Compound ID: | V022-7131 |
Compound Name: | 1-{4-[3-(3-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one |
Molecular Weight: | 472.59 |
Molecular Formula: | C27 H32 N6 O2 |
Salt: | not_available |
Smiles: | CC1CN(CCN1C(CC(C)(C)C)=O)c1nc2ccccc2c2nnc(c3cccc(c3)OC)n12 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.1735 |
logD: | 5.1246 |
logSw: | -5.2974 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 55.956 |
InChI Key: | GZFVQZMWNZUAQV-SFHVURJKSA-N |