9-(2-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(2-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
9-(2-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
Compound ID: | K832-4173 |
Compound Name: | 9-(2-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one |
Molecular Weight: | 329.79 |
Molecular Formula: | C16 H16 Cl N5 O |
Smiles: | CC1(C)CC2=C(C(c3ccccc3[Cl])n3c(N2)nnn3)C(C1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9984 |
logD: | 2.0456 |
logSw: | -3.447 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.034 |
InChI Key: | LFBMSEQJTDXMDM-AWEZNQCLSA-N |