TL;DR: Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione (CAS 151272-49-0) is a chemical compound with molecular formula C18H10N4O2 and molecular weight 314.08038 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,11,15-tetrazapentacyclo[12.8.0.02,11.04,9.016,21]docosa-2,4,6,8,12,14,16,18,20-nonaene-10,22-dione
Also Known As: pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione, 9H,16H-quinazolino[2',3':2,3]pyrimido[6,1-b]quinazoline-9,16-dione, 8,15-dihydroquinazolino[2',3'-3,2]pyrimidino[6,1-b]quinazoline-9,16-dione
| Molecular Formula | C18H10N4O2 |
| Molecular Weight | 314.08038 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 65.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.08038 Da |
| Heavy Atoms | 24 |
| Complexity | 695.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)N3C(=N2)C=CN4C3=NC5=CC=CC=C5C4=O |
| InChIKey | FGRPFJJTAYSEHJ-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione. The TPSA of 65.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione. Following Lipinski's Rule of Five, Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione has 0 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 Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione is 151272-49-0.
The molecular formula of Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione is C18H10N4O2.
The molecular weight of Pyrimido[2,1-b:4,3-b']diquinazoline-9,16-dione is 314.08038 g/mol.
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