BAS 10853862
TL;DR: BAS 10853862 (CAS 838866-07-2) is a chemical compound with molecular formula C22H29N5O2 and molecular weight 395.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-[(2-methylphenyl)methyl]-8-[(2-methylpiperidin-1-yl)methyl]purine-2,6-dione
Also Known As: BAS 10853862, UPCMLD0ENAT5839933:001, F0634-0171, 1,3-dimethyl-7-[(2-methylphenyl)methyl]-8-[(2-methylpiperidin-1-yl)methyl]purine-2,6-dione, 1,3-dimethyl-7-(2-methylbenzyl)-8-((2-methylpiperidin-1-yl)methyl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C22H29N5O2 |
|---|---|
| Molecular Weight | 395.23 g/mol |
| LogP | 2.16482 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.23212 |
| Heavy Atoms | 29 |
| Complexity | 1170.385 |
Chemical Identifiers
| CAS Number | 838866-07-2 |
|---|---|
| SMILES | CC1CCCCN1CC2=NC3=C(N2CC4=CC=CC=C4C)C(=O)N(C(=O)N3C)C |
Product Overview
BAS 10853862 (CAS 838866-07-2), with molecular formula C22H29N5O2 and molecular weight 395.23 g/mol. IUPAC: 1,3-dimethyl-7-[(2-methylphenyl)methyl]-8-[(2-methylpiperidin-1-yl)methyl]purine-2,6-dione.
Chemical Property Profile of BAS 10853862
Property Insights of BAS 10853862
The XLogP value of 2.16482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10853862. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10853862. Following Lipinski's Rule of Five, BAS 10853862 has 0 hydrogen bond donor(s) and 4 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 10853862?
The CAS number of BAS 10853862 is 838866-07-2.
What is the molecular formula of BAS 10853862?
The molecular formula of BAS 10853862 is C22H29N5O2.
What is the molecular weight of BAS 10853862?
The molecular weight of BAS 10853862 is 395.23 g/mol.
Where can I buy BAS 10853862?
You can request a quote for BAS 10853862 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10853862?
Yes, KEHONG BIO provides custom synthesis services for BAS 10853862 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.