AB00120708-01
TL;DR: AB00120708-01 (CAS 432527-29-2) is a chemical compound with molecular formula C23H24N4O4 and molecular weight 420.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone
Also Known As: AB00120708-01, [4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone, (2-furylmethyl){5-[4-(2-methylbenzoyl)-1-piperazinyl]-2-nitrophenyl}amine, (4-{3-[(furan-2-ylmethyl)amino]-4-nitrophenyl}piperazin-1-yl)(2-methylphenyl)methanone, 4-{3-[(2-furylmethyl)amino]-4-nitrophenyl}piperazinyl 2-methylphenyl ketone
| Molecular Formula | C23H24N4O4 |
|---|---|
| Molecular Weight | 420.18 g/mol |
| LogP | 4.07072 |
| Topological Polar Surface Area | 91.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.17975 |
| Heavy Atoms | 31 |
| Complexity | 1072.9403 |
Chemical Identifiers
| CAS Number | 432527-29-2 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCC4=CC=CO4 |
Product Overview
AB00120708-01 (CAS 432527-29-2), with molecular formula C23H24N4O4 and molecular weight 420.18 g/mol. IUPAC: [4-[3-(furan-2-ylmethylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone.
Chemical Property Profile of AB00120708-01
Property Insights of AB00120708-01
The XLogP value of 4.07072 indicates that AB00120708-01 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 AB00120708-01. Following Lipinski's Rule of Five, AB00120708-01 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 AB00120708-01?
The CAS number of AB00120708-01 is 432527-29-2.
What is the molecular formula of AB00120708-01?
The molecular formula of AB00120708-01 is C23H24N4O4.
What is the molecular weight of AB00120708-01?
The molecular weight of AB00120708-01 is 420.18 g/mol.
Where can I buy AB00120708-01?
You can request a quote for AB00120708-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00120708-01?
Yes, KEHONG BIO provides custom synthesis services for AB00120708-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.