BAS 01547173
TL;DR: BAS 01547173 (CAS 374103-08-9) is a chemical compound with molecular formula C18H18Cl2N4O2S and molecular weight 424.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(Z)-3-chlorobut-2-enyl]sulfanyl-7-[(2-chlorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 01547173, (Z)-7-(2-chlorobenzyl)-8-((3-chlorobut-2-en-1-yl)thio)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2-chlorobenzyl)-8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 8-[(Z)-3-chlorobut-2-enyl]sulfanyl-7-[(2-chlorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C18H18Cl2N4O2S |
|---|---|
| Molecular Weight | 424.05 g/mol |
| LogP | 3.3701 |
| Topological Polar Surface Area | 61.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.05276 |
| Heavy Atoms | 27 |
| Complexity | 1156.6036 |
Chemical Identifiers
| CAS Number | 374103-08-9 |
|---|---|
| SMILES | C/C(=C/CSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)N(C(=O)N2C)C)/Cl |
Product Overview
BAS 01547173 (CAS 374103-08-9), with molecular formula C18H18Cl2N4O2S and molecular weight 424.05 g/mol. IUPAC: 8-[(Z)-3-chlorobut-2-enyl]sulfanyl-7-[(2-chlorophenyl)methyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 01547173
Property Insights of BAS 01547173
The XLogP value of 3.3701 indicates that BAS 01547173 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01547173. Following Lipinski's Rule of Five, BAS 01547173 has 0 hydrogen bond donor(s) and 4 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 01547173?
The CAS number of BAS 01547173 is 374103-08-9.
What is the molecular formula of BAS 01547173?
The molecular formula of BAS 01547173 is C18H18Cl2N4O2S.
What is the molecular weight of BAS 01547173?
The molecular weight of BAS 01547173 is 424.05 g/mol.
Where can I buy BAS 01547173?
You can request a quote for BAS 01547173 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01547173?
Yes, KEHONG BIO provides custom synthesis services for BAS 01547173 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.