8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine
TL;DR: 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine (CAS 123811-36-9) is a chemical compound with molecular formula C15H15BrN6O and molecular weight 374.04907 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]formamide
Also Known As: Bdafbp, 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine, N-[3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]formamide, 6-Dimethylamino-8-bromo-9-(3-formylaminobenzyl)-9H-purine, Formamide,N-[3-[[8-bromo-6-(dimethylamino)-9H-purin-9-yl]methyl]phenyl]-
Technical Specifications
| Molecular Formula | C15H15BrN6O |
| Molecular Weight | 374.04907 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.04907 Da |
| Heavy Atoms | 23 |
| Complexity | 411.0 |
| SMILES | CN(C)C1=NC=NC2=C1N=C(N2CC3=CC(=CC=C3)NC=O)Br |
| InChIKey | UBWFXCGBEINYPB-UHFFFAOYSA-N |
Chemical Property Profile of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine
Property Insights of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine. Following Lipinski's Rule of Five, 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine?
The CAS number of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine is 123811-36-9.
What is the molecular formula of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine?
The molecular formula of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine is C15H15BrN6O.
What is the molecular weight of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine?
The molecular weight of 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine is 374.04907 g/mol.
Where can I buy 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine?
You can request a quote for 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine?
Yes, CoreyChem provides custom synthesis services for 8-Bromo-6-(dimethylamino)-9-(3-formamidobenzyl)-9H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.