A2613/0111103
TL;DR: A2613/0111103 (CAS 347309-03-9) is a chemical compound with molecular formula C21H23ClN4O4 and molecular weight 430.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-4-methoxyphenyl)-[4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl]methanone
Also Known As: A2613/0111103, (3-chloro-4-methoxyphenyl)-[4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl]methanone, (3-chloro-4-methoxyphenyl)(4-(3-(cyclopropylamino)-4-nitrophenyl)piperazin-1-yl)methanone, (3-chloro-4-methoxyphenyl){4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}methanone, (3-CHLORO-4-METHOXYPHENYL){4-[3-(CYCLOPROPYLAMINO)-4-NITROPHENYL]PIPERAZINO}METHANONE
| Molecular Formula | C21H23ClN4O4 |
|---|---|
| Molecular Weight | 430.14 g/mol |
| LogP | 3.7935 |
| Topological Polar Surface Area | 87.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.14078 |
| Heavy Atoms | 30 |
| Complexity | 971.4739 |
Chemical Identifiers
| CAS Number | 347309-03-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC4CC4)Cl |
Product Overview
A2613/0111103 (CAS 347309-03-9), with molecular formula C21H23ClN4O4 and molecular weight 430.14 g/mol. IUPAC: (3-chloro-4-methoxyphenyl)-[4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl]methanone.
Chemical Property Profile of A2613/0111103
Property Insights of A2613/0111103
The XLogP value of 3.7935 indicates that A2613/0111103 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 A2613/0111103. Following Lipinski's Rule of Five, A2613/0111103 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 A2613/0111103?
The CAS number of A2613/0111103 is 347309-03-9.
What is the molecular formula of A2613/0111103?
The molecular formula of A2613/0111103 is C21H23ClN4O4.
What is the molecular weight of A2613/0111103?
The molecular weight of A2613/0111103 is 430.14 g/mol.
Where can I buy A2613/0111103?
You can request a quote for A2613/0111103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2613/0111103?
Yes, KEHONG BIO provides custom synthesis services for A2613/0111103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.