9-bromo-1-ethyl-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-ethyl-3-(4-methylphenyl)-4a,10b-dihydro-2H-[1]benzopyrano[3,4-c]pyridine-2,4,5(1H,3H)-trione
9-bromo-1-ethyl-3-(4-methylphenyl)-4a,10b-dihydro-2H-[1]benzopyrano[3,4-c]pyridine-2,4,5(1H,3H)-trione
Compound characteristics
Compound ID: | 8014-8591 |
Compound Name: | 9-bromo-1-ethyl-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: | CCC1C2C(C(N(C1=O)c1ccc(C)cc1)=O)C(=O)Oc1ccc(cc12)[Br] |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.382 |
logD: | 1.7583 |
logSw: | -3.8669 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 49.436 |
InChI Key: | JYGFBQOMAKQUPL-UHFFFAOYSA-N |