AB00852685-06
TL;DR: AB00852685-06 (CAS 879576-92-8) is a chemical compound with molecular formula C21H25N7OS and molecular weight 423.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(1-phenyltetrazol-5-yl)sulfanylpropanamide
Also Known As: AB00852685-06, F3244-0004, N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(1-phenyltetrazol-5-yl)sulfanylpropanamide, N-[4-(4-methylpiperazin-1-yl)phenyl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propanamide, N-[4-(4-methylpiperazin-1-yl)phenyl]-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide
| Molecular Formula | C21H25N7OS |
|---|---|
| Molecular Weight | 423.18 g/mol |
| LogP | 2.5334 |
| Topological Polar Surface Area | 79.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.18414 |
| Heavy Atoms | 30 |
| Complexity | 968.53467 |
Chemical Identifiers
| CAS Number | 879576-92-8 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C)SC3=NN=NN3C4=CC=CC=C4 |
Product Overview
AB00852685-06 (CAS 879576-92-8), with molecular formula C21H25N7OS and molecular weight 423.18 g/mol. IUPAC: N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(1-phenyltetrazol-5-yl)sulfanylpropanamide.
Chemical Property Profile of AB00852685-06
Property Insights of AB00852685-06
The XLogP value of 2.5334 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00852685-06. The TPSA of 79.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00852685-06. Following Lipinski's Rule of Five, AB00852685-06 has 1 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 AB00852685-06?
The CAS number of AB00852685-06 is 879576-92-8.
What is the molecular formula of AB00852685-06?
The molecular formula of AB00852685-06 is C21H25N7OS.
What is the molecular weight of AB00852685-06?
The molecular weight of AB00852685-06 is 423.18 g/mol.
Where can I buy AB00852685-06?
You can request a quote for AB00852685-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00852685-06?
Yes, KEHONG BIO provides custom synthesis services for AB00852685-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.