AB00717885-01
TL;DR: AB00717885-01 (CAS 449180-01-2) is a chemical compound with molecular formula C25H22N4O2S and molecular weight 442.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethylphenyl)-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine
Also Known As: AB00717885-01, 1-(4-ethylphenyl)-3-tosyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine, 1-(4-ethylphenyl)-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine, 1-(4-ethylphenyl)-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-amine
| Molecular Formula | C25H22N4O2S |
|---|---|
| Molecular Weight | 442.15 g/mol |
| LogP | 4.85952 |
| Topological Polar Surface Area | 90.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.14636 |
| Heavy Atoms | 32 |
| Complexity | 1569.2174 |
Chemical Identifiers
| CAS Number | 449180-01-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=C(C=C5)C)N |
Product Overview
AB00717885-01 (CAS 449180-01-2), with molecular formula C25H22N4O2S and molecular weight 442.15 g/mol. IUPAC: 1-(4-ethylphenyl)-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-2-amine.
Chemical Property Profile of AB00717885-01
Property Insights of AB00717885-01
The XLogP value of 4.85952 indicates that AB00717885-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.87 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00717885-01. Following Lipinski's Rule of Five, AB00717885-01 has 1 hydrogen bond donor(s) and 5 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 AB00717885-01?
The CAS number of AB00717885-01 is 449180-01-2.
What is the molecular formula of AB00717885-01?
The molecular formula of AB00717885-01 is C25H22N4O2S.
What is the molecular weight of AB00717885-01?
The molecular weight of AB00717885-01 is 442.15 g/mol.
Where can I buy AB00717885-01?
You can request a quote for AB00717885-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00717885-01?
Yes, KEHONG BIO provides custom synthesis services for AB00717885-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.