AB00709548-01
TL;DR: AB00709548-01 (CAS 326870-40-0) is a chemical compound with molecular formula C26H29N5O5S and molecular weight 523.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-butyl-2-[[4-(dimethylsulfamoyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: AB00709548-01, ethyl 1-butyl-2-({[4-(dimethylsulfamoyl)phenyl]carbonyl}amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, ethyl 1-butyl-2-(4-(N,N-dimethylsulfamoyl)benzamido)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, ethyl 1-butyl-2-[[4-(dimethylsulfamoyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate
| Molecular Formula | C26H29N5O5S |
|---|---|
| Molecular Weight | 523.19 g/mol |
| LogP | 4.0639 |
| Topological Polar Surface Area | 123.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 523.18896 |
| Heavy Atoms | 37 |
| Complexity | 1576.7583 |
Chemical Identifiers
| CAS Number | 326870-40-0 |
|---|---|
| SMILES | CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)C |
Product Overview
AB00709548-01 (CAS 326870-40-0), with molecular formula C26H29N5O5S and molecular weight 523.19 g/mol. IUPAC: ethyl 1-butyl-2-[[4-(dimethylsulfamoyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of AB00709548-01
Property Insights of AB00709548-01
The XLogP value of 4.0639 indicates that AB00709548-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.49 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00709548-01. Following Lipinski's Rule of Five, AB00709548-01 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00709548-01?
The CAS number of AB00709548-01 is 326870-40-0.
What is the molecular formula of AB00709548-01?
The molecular formula of AB00709548-01 is C26H29N5O5S.
What is the molecular weight of AB00709548-01?
The molecular weight of AB00709548-01 is 523.19 g/mol.
Where can I buy AB00709548-01?
You can request a quote for AB00709548-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00709548-01?
Yes, KEHONG BIO provides custom synthesis services for AB00709548-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.