AB00109741-01
TL;DR: AB00109741-01 (CAS 347309-33-5) is a chemical compound with molecular formula C25H25ClN4O4 and molecular weight 480.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-[(4-chlorophenyl)methylamino]-4-nitrophenyl]piperazin-1-yl]-(2-methoxyphenyl)methanone
Also Known As: AB00109741-01, A2613/0111107, (4-{3-[(4-chlorobenzyl)amino]-4-nitrophenyl}piperazin-1-yl)(2-methoxyphenyl)methanone, [4-[3-[(4-chlorophenyl)methylamino]-4-nitrophenyl]piperazin-1-yl]-(2-methoxyphenyl)methanone, (4-(3-((4-chlorobenzyl)amino)-4-nitrophenyl)piperazin-1-yl)(2-methoxyphenyl)methanone
| Molecular Formula | C25H25ClN4O4 |
|---|---|
| Molecular Weight | 480.16 g/mol |
| LogP | 4.8313 |
| Topological Polar Surface Area | 87.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 480.15643 |
| Heavy Atoms | 34 |
| Complexity | 1177.7881 |
Chemical Identifiers
| CAS Number | 347309-33-5 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCC4=CC=C(C=C4)Cl |
Product Overview
AB00109741-01 (CAS 347309-33-5), with molecular formula C25H25ClN4O4 and molecular weight 480.16 g/mol. IUPAC: [4-[3-[(4-chlorophenyl)methylamino]-4-nitrophenyl]piperazin-1-yl]-(2-methoxyphenyl)methanone.
Chemical Property Profile of AB00109741-01
Property Insights of AB00109741-01
The XLogP value of 4.8313 indicates that AB00109741-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00109741-01. Following Lipinski's Rule of Five, AB00109741-01 has 1 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 AB00109741-01?
The CAS number of AB00109741-01 is 347309-33-5.
What is the molecular formula of AB00109741-01?
The molecular formula of AB00109741-01 is C25H25ClN4O4.
What is the molecular weight of AB00109741-01?
The molecular weight of AB00109741-01 is 480.16 g/mol.
Where can I buy AB00109741-01?
You can request a quote for AB00109741-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00109741-01?
Yes, KEHONG BIO provides custom synthesis services for AB00109741-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.