6-(4-methoxyphenyl)-9-(4-methylphenyl)-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
6-(4-methoxyphenyl)-9-(4-methylphenyl)-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
6-(4-methoxyphenyl)-9-(4-methylphenyl)-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | C202-3891 |
| Compound Name: | 6-(4-methoxyphenyl)-9-(4-methylphenyl)-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C22 H21 N5 O2 |
| Smiles: | Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)OC)Nc2nnnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0237 |
| logD: | 2.7426 |
| logSw: | -4.0963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.306 |
| InChI Key: | AGRDEMCSKFOGIG-UHFFFAOYSA-N |