TL;DR: BAS 12519827 (CAS 128839-36-1) is a chemical compound with molecular formula C19H23NO4 and molecular weight 329.16272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3,4-dimethoxyphenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinoline-2,5-dione
Also Known As: BAS 12519827, J1.648.597G, 4-(3,4-DIMETHOXYPHENYL)-7,7-DIMETHYL-1,2,3,4,5,6,7,8-OCTAHYDROQUINOLINE-2,5-DIONE, 4-(3,4-Dimethoxyphenyl)-7,7-dimethyl-3,4,7,8-tetrahydroquinoline-2,5(1H,6H)-dione, 4-(3,4-dimethoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
| Molecular Formula | C19H23NO4 |
| Molecular Weight | 329.16272 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.16272 Da |
| Heavy Atoms | 24 |
| Complexity | 566.0 |
| SMILES | CC1(CC2=C(C(CC(=O)N2)C3=CC(=C(C=C3)OC)OC)C(=O)C1)C |
| InChIKey | DGUNMASKZLGBBL-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12519827. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12519827. Following Lipinski's Rule of Five, BAS 12519827 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 12519827 is 128839-36-1.
The molecular formula of BAS 12519827 is C19H23NO4.
The molecular weight of BAS 12519827 is 329.16272 g/mol.
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