6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione
TL;DR: 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione (CAS 120075-43-6) is a chemical compound with molecular formula C17H22N6O2 and molecular weight 342.18042 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-bis(aziridin-1-yl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione
Also Known As: ADA-quinazolinedione, 6,7-Bis(1-aziridinyl)-4-((3-(N,N-dimethylamino)propyl)amino)-5,8-quinazolinedione, 6,7-bis(aziridin-1-yl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione, 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione, 6,7-Di(aziridin-1-yl)-4-((3-(dimethylamino)propyl)amino)quinazoline-5,8-dione
Technical Specifications
| Molecular Formula | C17H22N6O2 |
| Molecular Weight | 342.18042 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 81.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 342.18042 Da |
| Heavy Atoms | 25 |
| Complexity | 596.0 |
| SMILES | CN(C)CCCNC1=NC=NC2=C1C(=O)C(=C(C2=O)N3CC3)N4CC4 |
| InChIKey | VAQMBBQFJFTWPC-UHFFFAOYSA-N |
Chemical Property Profile of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione
Property Insights of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione. Following Lipinski's Rule of Five, 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione?
The CAS number of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione is 120075-43-6.
What is the molecular formula of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione?
The molecular formula of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione is C17H22N6O2.
What is the molecular weight of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione?
The molecular weight of 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione is 342.18042 g/mol.
Where can I buy 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione?
You can request a quote for 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione?
Yes, CoreyChem provides custom synthesis services for 6,7-Bis(1-aziridinyl)-4-((3-(dimethylamino)propyl)amino)-5,8-quinazolinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.