AS-871/15033738
TL;DR: AS-871/15033738 (CAS 452353-89-8) is a chemical compound with molecular formula C21H17N5O5S and molecular weight 451.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
Also Known As: AS-871/15033738, 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide, 2-(1,3-dioxoisoindol-2-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide, 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}propanamide, 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}propanamide
| Molecular Formula | C21H17N5O5S |
|---|---|
| Molecular Weight | 451.10 g/mol |
| LogP | 1.9006 |
| Topological Polar Surface Area | 138.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.09503 |
| Heavy Atoms | 32 |
| Complexity | 1274.9218 |
Chemical Identifiers
| CAS Number | 452353-89-8 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)N3C(=O)C4=CC=CC=C4C3=O |
Product Overview
AS-871/15033738 (CAS 452353-89-8), with molecular formula C21H17N5O5S and molecular weight 451.10 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide.
Chemical Property Profile of AS-871/15033738
Property Insights of AS-871/15033738
The XLogP value of 1.9006 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/15033738. The TPSA of 138.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/15033738. Following Lipinski's Rule of Five, AS-871/15033738 has 2 hydrogen bond donor(s) and 7 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-871/15033738?
The CAS number of AS-871/15033738 is 452353-89-8.
What is the molecular formula of AS-871/15033738?
The molecular formula of AS-871/15033738 is C21H17N5O5S.
What is the molecular weight of AS-871/15033738?
The molecular weight of AS-871/15033738 is 451.10 g/mol.
Where can I buy AS-871/15033738?
You can request a quote for AS-871/15033738 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/15033738?
Yes, KEHONG BIO provides custom synthesis services for AS-871/15033738 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.