BAS 09857695
TL;DR: BAS 09857695 (CAS 850189-39-8) is a chemical compound with molecular formula C18H24N6O2 and molecular weight 356.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(dimethylamino)ethylamino]-3-methyl-7-[(4-methylphenyl)methyl]purine-2,6-dione
Also Known As: BAS 09857695, 8-((2-(dimethylamino)ethyl)amino)-3-methyl-7-(4-methylbenzyl)-1H-purine-2,6(3H,7H)-dione, 8-(2-dimethylaminoethylamino)-3-methyl-7-[(4-methylphenyl)methyl]purine-2,6-dione, 8-{[2-(DIMETHYLAMINO)ETHYL]AMINO}-3-METHYL-7-[(4-METHYLPHENYL)METHYL]-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE, 8-{[2-(dimethylamino)ethyl]amino}-6-hydroxy-3-methyl-7-(4-methylbenzyl)-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C18H24N6O2 |
|---|---|
| Molecular Weight | 356.20 g/mol |
| LogP | 0.75352 |
| Topological Polar Surface Area | 87.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.19608 |
| Heavy Atoms | 26 |
| Complexity | 1026.7465 |
Chemical Identifiers
| CAS Number | 850189-39-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=C(N=C2NCCN(C)C)N(C(=O)NC3=O)C |
Product Overview
BAS 09857695 (CAS 850189-39-8), with molecular formula C18H24N6O2 and molecular weight 356.20 g/mol. IUPAC: 8-[2-(dimethylamino)ethylamino]-3-methyl-7-[(4-methylphenyl)methyl]purine-2,6-dione.
Chemical Property Profile of BAS 09857695
Property Insights of BAS 09857695
The XLogP value of 0.75352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09857695. The TPSA of 87.95 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09857695. Following Lipinski's Rule of Five, BAS 09857695 has 2 hydrogen bond donor(s) and 5 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 09857695?
The CAS number of BAS 09857695 is 850189-39-8.
What is the molecular formula of BAS 09857695?
The molecular formula of BAS 09857695 is C18H24N6O2.
What is the molecular weight of BAS 09857695?
The molecular weight of BAS 09857695 is 356.20 g/mol.
Where can I buy BAS 09857695?
You can request a quote for BAS 09857695 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09857695?
Yes, KEHONG BIO provides custom synthesis services for BAS 09857695 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.