12-(5-bromo-2-methoxyphenyl)-3,3-dimethyl-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
Chemical Structure Depiction of
12-(5-bromo-2-methoxyphenyl)-3,3-dimethyl-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
12-(5-bromo-2-methoxyphenyl)-3,3-dimethyl-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one
Compound characteristics
| Compound ID: | K832-3271 |
| Compound Name: | 12-(5-bromo-2-methoxyphenyl)-3,3-dimethyl-3,4,5,12-tetrahydrobenzimidazo[2,1-b]quinazolin-1(2H)-one |
| Molecular Weight: | 452.35 |
| Molecular Formula: | C23 H22 Br N3 O2 |
| Smiles: | CC1(C)CC2=C(C(c3cc(ccc3OC)[Br])n3c4ccccc4nc3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5074 |
| logD: | 5.4906 |
| logSw: | -5.4245 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.232 |
| InChI Key: | SJJHSPRGUCHKEN-NRFANRHFSA-N |