BAS 00732947
TL;DR: BAS 00732947 (CAS 303969-57-5) is a chemical compound with molecular formula C14H20ClN5O3 and molecular weight 341.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-chloro-2-hydroxypropyl)-3-methyl-8-piperidin-1-ylpurine-2,6-dione
Also Known As: BAS 00732947, 7-(3-chloro-2-hydroxypropyl)-3-methyl-8-piperidin-1-ylpurine-2,6-dione, 7-(3-chloro-2-hydroxypropyl)-3-methyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione, 7-(3-chloro-2-hydroxypropyl)-3-methyl-8-(piperidin-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 7-(3-chloro-2-hydroxypropyl)-6-hydroxy-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C14H20ClN5O3 |
|---|---|
| Molecular Weight | 341.13 g/mol |
| LogP | 0.0133 |
| Topological Polar Surface Area | 96.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.12546 |
| Heavy Atoms | 23 |
| Complexity | 818.15265 |
Chemical Identifiers
| CAS Number | 303969-57-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CC(CCl)O |
Product Overview
BAS 00732947 (CAS 303969-57-5), with molecular formula C14H20ClN5O3 and molecular weight 341.13 g/mol. IUPAC: 7-(3-chloro-2-hydroxypropyl)-3-methyl-8-piperidin-1-ylpurine-2,6-dione.
Chemical Property Profile of BAS 00732947
Property Insights of BAS 00732947
The XLogP value of 0.0133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00732947. The TPSA of 96.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00732947. Following Lipinski's Rule of Five, BAS 00732947 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 00732947?
The CAS number of BAS 00732947 is 303969-57-5.
What is the molecular formula of BAS 00732947?
The molecular formula of BAS 00732947 is C14H20ClN5O3.
What is the molecular weight of BAS 00732947?
The molecular weight of BAS 00732947 is 341.13 g/mol.
Where can I buy BAS 00732947?
You can request a quote for BAS 00732947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00732947?
Yes, KEHONG BIO provides custom synthesis services for BAS 00732947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.