9-bromo-1,1-dimethyl-3-(4-methylphenyl)-4a,10b-dihydro-2H-[1]benzopyrano[3,4-c]pyridine-2,4,5(1H,3H)-trione
Chemical Structure Depiction of
9-bromo-1,1-dimethyl-3-(4-methylphenyl)-4a,10b-dihydro-2H-[1]benzopyrano[3,4-c]pyridine-2,4,5(1H,3H)-trione
9-bromo-1,1-dimethyl-3-(4-methylphenyl)-4a,10b-dihydro-2H-[1]benzopyrano[3,4-c]pyridine-2,4,5(1H,3H)-trione
Compound characteristics
| Compound ID: | 8015-1325 |
| Compound Name: | 9-bromo-1,1-dimethyl-3-(4-methylphenyl)-4a,10b-dihydro-2H-[1]benzopyrano[3,4-c]pyridine-2,4,5(1H,3H)-trione |
| Molecular Weight: | 428.28 |
| Molecular Formula: | C21 H18 Br N O4 |
| Smiles: | Cc1ccc(cc1)N1C(C2C(c3cc(ccc3OC2=O)[Br])C(C)(C)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7537 |
| logD: | 1.5456 |
| logSw: | -3.9533 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.436 |
| InChI Key: | DJDXMIVSCGGMBJ-UHFFFAOYSA-N |