AS-871/43478405
TL;DR: AS-871/43478405 (CAS 691396-49-3) is a chemical compound with molecular formula C20H21N7O2S and molecular weight 423.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-7-(benzenesulfonyl)-5-[2-(diethylamino)ethyl]pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
Also Known As: AS-871/43478405, 6-amino-7-(benzenesulfonyl)-5-[2-(diethylamino)ethyl]-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile, 6-amino-5-(2-diethylaminoethyl)-7-phenylsulfonyl-5H-pyrrolo[ 2,3-dicarbonitrile, 6-Amino-5-(2-diethylaminoethyl)-7-phenylsulfonyl-5H-pyrrolo[2,3-dicarbonitrile, 6-amino-5-[2-(diethylamino)ethyl]-7-(phenylsulfonyl)-5H-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile
| Molecular Formula | C20H21N7O2S |
|---|---|
| Molecular Weight | 423.15 g/mol |
| LogP | 1.93146 |
| Topological Polar Surface Area | 141.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 423.14774 |
| Heavy Atoms | 30 |
| Complexity | 1264.7029 |
Chemical Identifiers
| CAS Number | 691396-49-3 |
|---|---|
| SMILES | CCN(CC)CCN1C(=C(C2=NC(=C(N=C21)C#N)C#N)S(=O)(=O)C3=CC=CC=C3)N |
Product Overview
AS-871/43478405 (CAS 691396-49-3), with molecular formula C20H21N7O2S and molecular weight 423.15 g/mol. IUPAC: 6-amino-7-(benzenesulfonyl)-5-[2-(diethylamino)ethyl]pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile.
Chemical Property Profile of AS-871/43478405
Property Insights of AS-871/43478405
The XLogP value of 1.93146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/43478405. The TPSA of 141.69 Ų indicates high polarity, suggesting AS-871/43478405 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AS-871/43478405 has 1 hydrogen bond donor(s) and 8 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 AS-871/43478405?
The CAS number of AS-871/43478405 is 691396-49-3.
What is the molecular formula of AS-871/43478405?
The molecular formula of AS-871/43478405 is C20H21N7O2S.
What is the molecular weight of AS-871/43478405?
The molecular weight of AS-871/43478405 is 423.15 g/mol.
Where can I buy AS-871/43478405?
You can request a quote for AS-871/43478405 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/43478405?
Yes, KEHONG BIO provides custom synthesis services for AS-871/43478405 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.