(11aRS)-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Chemical Structure Depiction of
(11aRS)-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
(11aRS)-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y042-8041 |
| Compound Name: | (11aRS)-2-(4-ethoxyphenyl)-5-(4-methylphenyl)-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indole-1,3(2H)-dione |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C28 H25 N3 O3 |
| Smiles: | CCOc1ccc(cc1)N1C([C@@H]2Cc3c4ccccc4[nH]c3C(c3ccc(C)cc3)N2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0535 |
| logD: | 5.0535 |
| logSw: | -4.7732 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.664 |
| InChI Key: | ZPUQXVIVWZCGDY-RMVMEJTISA-N |