BAS 15375040
TL;DR: BAS 15375040 (CAS 879071-95-1) is a chemical compound with molecular formula C19H23ClN6O4 and molecular weight 434.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-piperazin-1-ylpurine-2,6-dione
Also Known As: BAS 15375040, VU0512721-1, F3176-0196, 7-(3-(4-chlorophenoxy)-2-hydroxypropyl)-3-methyl-8-(piperazin-1-yl)-1H-purine-2,6(3H,7H)-dione, 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-piperazin-1-ylpurine-2,6-dione
| Molecular Formula | C19H23ClN6O4 |
|---|---|
| Molecular Weight | 434.15 g/mol |
| LogP | -0.0738 |
| Topological Polar Surface Area | 117.41 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.14694 |
| Heavy Atoms | 30 |
| Complexity | 1146.7715 |
Chemical Identifiers
| CAS Number | 879071-95-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCNCC3)CC(COC4=CC=C(C=C4)Cl)O |
Product Overview
BAS 15375040 (CAS 879071-95-1), with molecular formula C19H23ClN6O4 and molecular weight 434.15 g/mol. IUPAC: 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-piperazin-1-ylpurine-2,6-dione.
Chemical Property Profile of BAS 15375040
Property Insights of BAS 15375040
The XLogP value of -0.0738 indicates that BAS 15375040 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.41 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 15375040. Following Lipinski's Rule of Five, BAS 15375040 has 3 hydrogen bond donor(s) and 7 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 15375040?
The CAS number of BAS 15375040 is 879071-95-1.
What is the molecular formula of BAS 15375040?
The molecular formula of BAS 15375040 is C19H23ClN6O4.
What is the molecular weight of BAS 15375040?
The molecular weight of BAS 15375040 is 434.15 g/mol.
Where can I buy BAS 15375040?
You can request a quote for BAS 15375040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 15375040?
Yes, KEHONG BIO provides custom synthesis services for BAS 15375040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.