9-(2,5-dimethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(2,5-dimethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
9-(2,5-dimethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | K832-3060 |
| Compound Name: | 9-(2,5-dimethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydrotetrazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C18 H21 N5 O3 |
| Smiles: | CC1(C)CC2=C(C(c3cc(ccc3OC)OC)n3c(N2)nnn3)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6016 |
| logD: | 1.5011 |
| logSw: | -3.0993 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.208 |
| InChI Key: | NAKBBGCAAFXSHE-INIZCTEOSA-N |