BAS 15374672
TL;DR: BAS 15374672 (CAS 878452-05-2) is a chemical compound with molecular formula C21H20N6O3 and molecular weight 404.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-phenacyl-8-(pyridin-3-ylmethylamino)purine-2,6-dione
Also Known As: BAS 15374672, VU0510657-1, AB00689204-01, F3144-0027, 1,3-dimethyl-7-phenacyl-8-(pyridin-3-ylmethylamino)purine-2,6-dione
| Molecular Formula | C21H20N6O3 |
|---|---|
| Molecular Weight | 404.16 g/mol |
| LogP | 1.3237 |
| Topological Polar Surface Area | 103.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.1597 |
| Heavy Atoms | 30 |
| Complexity | 1336.6722 |
Chemical Identifiers
| CAS Number | 878452-05-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CN=CC=C3)CC(=O)C4=CC=CC=C4 |
Product Overview
BAS 15374672 (CAS 878452-05-2), with molecular formula C21H20N6O3 and molecular weight 404.16 g/mol. IUPAC: 1,3-dimethyl-7-phenacyl-8-(pyridin-3-ylmethylamino)purine-2,6-dione.
Chemical Property Profile of BAS 15374672
Property Insights of BAS 15374672
The XLogP value of 1.3237 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 15374672. The TPSA of 103.81 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 15374672. Following Lipinski's Rule of Five, BAS 15374672 has 1 hydrogen bond donor(s) and 6 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 15374672?
The CAS number of BAS 15374672 is 878452-05-2.
What is the molecular formula of BAS 15374672?
The molecular formula of BAS 15374672 is C21H20N6O3.
What is the molecular weight of BAS 15374672?
The molecular weight of BAS 15374672 is 404.16 g/mol.
Where can I buy BAS 15374672?
You can request a quote for BAS 15374672 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 15374672?
Yes, KEHONG BIO provides custom synthesis services for BAS 15374672 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.