AE-641/12113090
TL;DR: AE-641/12113090 (CAS 301681-67-4) is a chemical compound with molecular formula C25H26N4O6S and molecular weight 510.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-2-(1,3-dioxoisoindol-2-yl)-4-methylpentanamide
Also Known As: AE-641/12113090, N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-2-(1,3-dioxoisoindol-2-yl)-4-methylpentanamide, N-{4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-methylpentanamide, N-[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]-4-methyl-2-phthalimido-valeramide, 2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-4-methyl-pentanoic acid [4-(3,4-dimethyl-isoxazol-5-ylsulfamoyl)-phenyl]-amide
| Molecular Formula | C25H26N4O6S |
|---|---|
| Molecular Weight | 510.16 g/mol |
| LogP | 3.74164 |
| Topological Polar Surface Area | 138.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 510.15732 |
| Heavy Atoms | 36 |
| Complexity | 1408.4325 |
Chemical Identifiers
| CAS Number | 301681-67-4 |
|---|---|
| SMILES | CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C(CC(C)C)N3C(=O)C4=CC=CC=C4C3=O |
Product Overview
AE-641/12113090 (CAS 301681-67-4), with molecular formula C25H26N4O6S and molecular weight 510.16 g/mol. IUPAC: N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-2-(1,3-dioxoisoindol-2-yl)-4-methylpentanamide.
Chemical Property Profile of AE-641/12113090
Property Insights of AE-641/12113090
The XLogP value of 3.74164 indicates that AE-641/12113090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.68 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-641/12113090. Following Lipinski's Rule of Five, AE-641/12113090 has 2 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 AE-641/12113090?
The CAS number of AE-641/12113090 is 301681-67-4.
What is the molecular formula of AE-641/12113090?
The molecular formula of AE-641/12113090 is C25H26N4O6S.
What is the molecular weight of AE-641/12113090?
The molecular weight of AE-641/12113090 is 510.16 g/mol.
Where can I buy AE-641/12113090?
You can request a quote for AE-641/12113090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/12113090?
Yes, KEHONG BIO provides custom synthesis services for AE-641/12113090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.