A3084/0130474
TL;DR: A3084/0130474 (CAS 433698-98-7) is a chemical compound with molecular formula C20H26N4O4 and molecular weight 386.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-3-methylbutan-1-one
Also Known As: A3084/0130474, 1-[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-3-methylbutan-1-one, 1-(4-{3-[(furan-2-ylmethyl)amino]-4-nitrophenyl}piperazin-1-yl)-3-methylbutan-1-one, 1-[4-(3-{[(FURAN-2-YL)METHYL]AMINO}-4-NITROPHENYL)PIPERAZIN-1-YL]-3-METHYLBUTAN-1-ONE
| Molecular Formula | C20H26N4O4 |
|---|---|
| Molecular Weight | 386.20 g/mol |
| LogP | 3.4946 |
| Topological Polar Surface Area | 91.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 386.1954 |
| Heavy Atoms | 28 |
| Complexity | 811.6181 |
Chemical Identifiers
| CAS Number | 433698-98-7 |
|---|---|
| SMILES | CC(C)CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3 |
Product Overview
A3084/0130474 (CAS 433698-98-7), with molecular formula C20H26N4O4 and molecular weight 386.20 g/mol. IUPAC: 1-[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-3-methylbutan-1-one.
Chemical Property Profile of A3084/0130474
Property Insights of A3084/0130474
The XLogP value of 3.4946 indicates that A3084/0130474 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.86 Ų falls within the moderate polarity range, balancing permeability and solubility for A3084/0130474. Following Lipinski's Rule of Five, A3084/0130474 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 A3084/0130474?
The CAS number of A3084/0130474 is 433698-98-7.
What is the molecular formula of A3084/0130474?
The molecular formula of A3084/0130474 is C20H26N4O4.
What is the molecular weight of A3084/0130474?
The molecular weight of A3084/0130474 is 386.20 g/mol.
Where can I buy A3084/0130474?
You can request a quote for A3084/0130474 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3084/0130474?
Yes, KEHONG BIO provides custom synthesis services for A3084/0130474 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.