BAS 05021940
TL;DR: BAS 05021940 (CAS 305864-73-7) is a chemical compound with molecular formula C20H19FN6O2 and molecular weight 394.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-2-ylmethylamino)purine-2,6-dione
Also Known As: BAS 05021940, AN-512/13208082, 1-(2-fluorobenzyl)-3,7-dimethyl-8-[(2-pyridinylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione, 1-(2-fluorobenzyl)-3,7-dimethyl-8-[(pyridin-2-ylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione, 1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-2-ylmethylamino)purine-2,6-dione
| Molecular Formula | C20H19FN6O2 |
|---|---|
| Molecular Weight | 394.16 g/mol |
| LogP | 1.6282 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.15536 |
| Heavy Atoms | 29 |
| Complexity | 1306.5386 |
Chemical Identifiers
| CAS Number | 305864-73-7 |
|---|---|
| SMILES | CN1C2=C(N=C1NCC3=CC=CC=N3)N(C(=O)N(C2=O)CC4=CC=CC=C4F)C |
Product Overview
BAS 05021940 (CAS 305864-73-7), with molecular formula C20H19FN6O2 and molecular weight 394.16 g/mol. IUPAC: 1-[(2-fluorophenyl)methyl]-3,7-dimethyl-8-(pyridin-2-ylmethylamino)purine-2,6-dione.
Chemical Property Profile of BAS 05021940
Property Insights of BAS 05021940
The XLogP value of 1.6282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05021940. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05021940. Following Lipinski's Rule of Five, BAS 05021940 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
Frequently Asked Questions
What is the CAS number of BAS 05021940?
The CAS number of BAS 05021940 is 305864-73-7.
What is the molecular formula of BAS 05021940?
The molecular formula of BAS 05021940 is C20H19FN6O2.
What is the molecular weight of BAS 05021940?
The molecular weight of BAS 05021940 is 394.16 g/mol.
Where can I buy BAS 05021940?
You can request a quote for BAS 05021940 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05021940?
Yes, KEHONG BIO provides custom synthesis services for BAS 05021940 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.