BAS 15374731
TL;DR: BAS 15374731 (CAS 878452-55-2) is a chemical compound with molecular formula C20H25FN6O3 and molecular weight 416.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-fluorophenyl)methyl]-3-methyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione
Also Known As: BAS 15374731, VU0510668-1, AB00683078-01, AB00683078-02, 7-(4-fluorobenzyl)-3-methyl-8-((3-morpholinopropyl)amino)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C20H25FN6O3 |
|---|---|
| Molecular Weight | 416.20 g/mol |
| LogP | 0.7449 |
| Topological Polar Surface Area | 97.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.1972 |
| Heavy Atoms | 30 |
| Complexity | 1128.3798 |
Chemical Identifiers
| CAS Number | 878452-55-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCCN3CCOCC3)CC4=CC=C(C=C4)F |
Product Overview
BAS 15374731 (CAS 878452-55-2), with molecular formula C20H25FN6O3 and molecular weight 416.20 g/mol. IUPAC: 7-[(4-fluorophenyl)methyl]-3-methyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione.
Chemical Property Profile of BAS 15374731
Property Insights of BAS 15374731
The XLogP value of 0.7449 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 15374731. The TPSA of 97.18 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 15374731. Following Lipinski's Rule of Five, BAS 15374731 has 2 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 15374731?
The CAS number of BAS 15374731 is 878452-55-2.
What is the molecular formula of BAS 15374731?
The molecular formula of BAS 15374731 is C20H25FN6O3.
What is the molecular weight of BAS 15374731?
The molecular weight of BAS 15374731 is 416.20 g/mol.
Where can I buy BAS 15374731?
You can request a quote for BAS 15374731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 15374731?
Yes, KEHONG BIO provides custom synthesis services for BAS 15374731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.