BAS 03571832
TL;DR: BAS 03571832 (CAS 500149-02-0) is a chemical compound with molecular formula C22H31N5O5 and molecular weight 445.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(hexylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione
Also Known As: BAS 03571832, 8-(hexylamino)-7-(2-hydroxy-3-(4-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, F1064-0034, 8-(hexylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione, 8-(hexylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C22H31N5O5 |
|---|---|
| Molecular Weight | 445.23 g/mol |
| LogP | 1.864 |
| Topological Polar Surface Area | 123.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 445.2325 |
| Heavy Atoms | 32 |
| Complexity | 1132.5496 |
Chemical Identifiers
| CAS Number | 500149-02-0 |
|---|---|
| SMILES | CCCCCCNC1=NC2=C(N1CC(COC3=CC=C(C=C3)OC)O)C(=O)NC(=O)N2C |
Product Overview
BAS 03571832 (CAS 500149-02-0), with molecular formula C22H31N5O5 and molecular weight 445.23 g/mol. IUPAC: 8-(hexylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 03571832
Property Insights of BAS 03571832
The XLogP value of 1.864 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03571832. The TPSA of 123.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03571832. Following Lipinski's Rule of Five, BAS 03571832 has 3 hydrogen bond donor(s) and 7 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 03571832?
The CAS number of BAS 03571832 is 500149-02-0.
What is the molecular formula of BAS 03571832?
The molecular formula of BAS 03571832 is C22H31N5O5.
What is the molecular weight of BAS 03571832?
The molecular weight of BAS 03571832 is 445.23 g/mol.
Where can I buy BAS 03571832?
You can request a quote for BAS 03571832 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03571832?
Yes, KEHONG BIO provides custom synthesis services for BAS 03571832 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.