BAS 03041338
TL;DR: BAS 03041338 (CAS 401918-10-3) is a chemical compound with molecular formula C19H23ClN6O3 and molecular weight 418.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-chlorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpurine-2,6-dione
Also Known As: BAS 03041338, UPCMLD0ENAT5836666:001, AB00818685-06, 7-[(2-chlorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpurine-2,6-dione, 7-(2-Chloro-benzyl)-8-[4-(2-hydroxy-ethyl)-piperazin-1-yl]-3-methyl-3,7-dihydro-purine-2,6-dione
| Molecular Formula | C19H23ClN6O3 |
|---|---|
| Molecular Weight | 418.15 g/mol |
| LogP | 0.2393 |
| Topological Polar Surface Area | 99.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.152 |
| Heavy Atoms | 29 |
| Complexity | 1143.0325 |
Chemical Identifiers
| CAS Number | 401918-10-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CCO)CC4=CC=CC=C4Cl |
Product Overview
BAS 03041338 (CAS 401918-10-3), with molecular formula C19H23ClN6O3 and molecular weight 418.15 g/mol. IUPAC: 7-[(2-chlorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 03041338
Property Insights of BAS 03041338
The XLogP value of 0.2393 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03041338. The TPSA of 99.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03041338. Following Lipinski's Rule of Five, BAS 03041338 has 2 hydrogen bond donor(s) and 6 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 03041338?
The CAS number of BAS 03041338 is 401918-10-3.
What is the molecular formula of BAS 03041338?
The molecular formula of BAS 03041338 is C19H23ClN6O3.
What is the molecular weight of BAS 03041338?
The molecular weight of BAS 03041338 is 418.15 g/mol.
Where can I buy BAS 03041338?
You can request a quote for BAS 03041338 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03041338?
Yes, KEHONG BIO provides custom synthesis services for BAS 03041338 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.