BAS 02999210
TL;DR: BAS 02999210 (CAS 333755-54-7) is a chemical compound with molecular formula C20H27N5O5 and molecular weight 417.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(butylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione
Also Known As: BAS 02999210, 8-(butylamino)-7-(2-hydroxy-3-(4-methoxyphenoxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, F0887-0146, 8-(butylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-(butylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione
| Molecular Formula | C20H27N5O5 |
|---|---|
| Molecular Weight | 417.20 g/mol |
| LogP | 1.0838 |
| Topological Polar Surface Area | 123.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 417.20123 |
| Heavy Atoms | 30 |
| Complexity | 1099.7031 |
Chemical Identifiers
| CAS Number | 333755-54-7 |
|---|---|
| SMILES | CCCCNC1=NC2=C(N1CC(COC3=CC=C(C=C3)OC)O)C(=O)NC(=O)N2C |
Product Overview
BAS 02999210 (CAS 333755-54-7), with molecular formula C20H27N5O5 and molecular weight 417.20 g/mol. IUPAC: 8-(butylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 02999210
Property Insights of BAS 02999210
The XLogP value of 1.0838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02999210. The TPSA of 123.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02999210. Following Lipinski's Rule of Five, BAS 02999210 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 02999210?
The CAS number of BAS 02999210 is 333755-54-7.
What is the molecular formula of BAS 02999210?
The molecular formula of BAS 02999210 is C20H27N5O5.
What is the molecular weight of BAS 02999210?
The molecular weight of BAS 02999210 is 417.20 g/mol.
Where can I buy BAS 02999210?
You can request a quote for BAS 02999210 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02999210?
Yes, KEHONG BIO provides custom synthesis services for BAS 02999210 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.