BAS 15375021
TL;DR: BAS 15375021 (CAS 879071-76-8) is a chemical compound with molecular formula C21H29N5O4 and molecular weight 415.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(diethylamino)-7-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-3-methylpurine-2,6-dione
Also Known As: BAS 15375021, VU0512712-1, 8-(diethylamino)-7-(3-(3,4-dimethylphenoxy)-2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, F3176-0177, 8-(diethylamino)-7-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-3-methylpurine-2,6-dione
| Molecular Formula | C21H29N5O4 |
|---|---|
| Molecular Weight | 415.22 g/mol |
| LogP | 1.32624 |
| Topological Polar Surface Area | 105.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 415.22195 |
| Heavy Atoms | 30 |
| Complexity | 1156.6387 |
Chemical Identifiers
| CAS Number | 879071-76-8 |
|---|---|
| SMILES | CCN(CC)C1=NC2=C(N1CC(COC3=CC(=C(C=C3)C)C)O)C(=O)NC(=O)N2C |
Product Overview
BAS 15375021 (CAS 879071-76-8), with molecular formula C21H29N5O4 and molecular weight 415.22 g/mol. IUPAC: 8-(diethylamino)-7-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 15375021
Property Insights of BAS 15375021
The XLogP value of 1.32624 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 15375021. The TPSA of 105.38 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 15375021. Following Lipinski's Rule of Five, BAS 15375021 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 15375021?
The CAS number of BAS 15375021 is 879071-76-8.
What is the molecular formula of BAS 15375021?
The molecular formula of BAS 15375021 is C21H29N5O4.
What is the molecular weight of BAS 15375021?
The molecular weight of BAS 15375021 is 415.22 g/mol.
Where can I buy BAS 15375021?
You can request a quote for BAS 15375021 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 15375021?
Yes, KEHONG BIO provides custom synthesis services for BAS 15375021 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.