TL;DR: 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione (CAS 120075-57-2) is a chemical compound with molecular formula C14H18N4O3 and molecular weight 290.13788 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[3-(dimethylamino)propylamino]-6-methoxyquinazoline-5,8-dione
Also Known As: 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione, 4-[3-(dimethylamino)propylamino]-6-methoxyquinazoline-5,8-dione, 4-(3-dimethylaminopropylamino)-6-methoxy-quinazoline-5,8-dione, 4-(3-Dimethylaminopropylamino)-6-methoxyquinazoline-5,8-dione, 4-{[3-(dimethylamino)propyl]amino}-6-methoxyquinazoline-5,8-dione
| Molecular Formula | C14H18N4O3 |
| Molecular Weight | 290.13788 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 84.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.13788 Da |
| Heavy Atoms | 21 |
| Complexity | 436.0 |
| SMILES | CN(C)CCCNC1=NC=NC2=C1C(=O)C(=CC2=O)OC |
| InChIKey | XMEQVWNXYMYXAB-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione. Following Lipinski's Rule of Five, 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione is 120075-57-2.
The molecular formula of 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione is C14H18N4O3.
The molecular weight of 6-Methoxy-4-(3-(N,N-dimethylamino)propylamino)-5,8-quinazolinedione is 290.13788 g/mol.
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