BAS 07401652
TL;DR: BAS 07401652 (CAS 579446-64-3) is a chemical compound with molecular formula C18H27N5O3 and molecular weight 361.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-7-(3-oxobutan-2-yl)purine-2,6-dione
Also Known As: BAS 07401652, UPCMLD0ENAT5774737:001, 1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-7-(3-oxobutan-2-yl)purine-2,6-dione, 1,3-dimethyl-7-(1-methyl-2-oxopropyl)-8-[(2-methylpiperidin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione, 1,3-dimethyl-7-(1-methyl-2-oxopropyl)-8-[(2-methylpiperidyl)methyl]-1,3,7-trih ydropurine-2,6-dione
| Molecular Formula | C18H27N5O3 |
|---|---|
| Molecular Weight | 361.21 g/mol |
| LogP | 0.9581 |
| Topological Polar Surface Area | 82.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.2114 |
| Heavy Atoms | 26 |
| Complexity | 967.8326 |
Chemical Identifiers
| CAS Number | 579446-64-3 |
|---|---|
| SMILES | CC1CCCCN1CC2=NC3=C(N2C(C)C(=O)C)C(=O)N(C(=O)N3C)C |
Product Overview
BAS 07401652 (CAS 579446-64-3), with molecular formula C18H27N5O3 and molecular weight 361.21 g/mol. IUPAC: 1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]-7-(3-oxobutan-2-yl)purine-2,6-dione.
Chemical Property Profile of BAS 07401652
Property Insights of BAS 07401652
The XLogP value of 0.9581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07401652. The TPSA of 82.13 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07401652. Following Lipinski's Rule of Five, BAS 07401652 has 0 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 07401652?
The CAS number of BAS 07401652 is 579446-64-3.
What is the molecular formula of BAS 07401652?
The molecular formula of BAS 07401652 is C18H27N5O3.
What is the molecular weight of BAS 07401652?
The molecular weight of BAS 07401652 is 361.21 g/mol.
Where can I buy BAS 07401652?
You can request a quote for BAS 07401652 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07401652?
Yes, KEHONG BIO provides custom synthesis services for BAS 07401652 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.