BAS 13323581
TL;DR: BAS 13323581 (CAS 887599-15-7) is a chemical compound with molecular formula C21H22N4O4S and molecular weight 426.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enylsulfamoyl]phenyl]acetamide
Also Known As: BAS 13323581, N-(4-(N-allyl-N-((3-(m-tolyl)-1,2,4-oxadiazol-5-yl)methyl)sulfamoyl)phenyl)acetamide, N-[4-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enylsulfamoyl]phenyl]acetamide, N-{4-[{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}(prop-2-en-1-yl)sulfamoyl]phenyl}acetamide
| Molecular Formula | C21H22N4O4S |
|---|---|
| Molecular Weight | 426.14 g/mol |
| LogP | 3.38032 |
| Topological Polar Surface Area | 105.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.13617 |
| Heavy Atoms | 30 |
| Complexity | 1153.7593 |
Chemical Identifiers
| CAS Number | 887599-15-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NOC(=N2)CN(CC=C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C |
Product Overview
BAS 13323581 (CAS 887599-15-7), with molecular formula C21H22N4O4S and molecular weight 426.14 g/mol. IUPAC: N-[4-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enylsulfamoyl]phenyl]acetamide.
Chemical Property Profile of BAS 13323581
Property Insights of BAS 13323581
The XLogP value of 3.38032 indicates that BAS 13323581 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13323581. Following Lipinski's Rule of Five, BAS 13323581 has 1 hydrogen bond donor(s) and 6 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 BAS 13323581?
The CAS number of BAS 13323581 is 887599-15-7.
What is the molecular formula of BAS 13323581?
The molecular formula of BAS 13323581 is C21H22N4O4S.
What is the molecular weight of BAS 13323581?
The molecular weight of BAS 13323581 is 426.14 g/mol.
Where can I buy BAS 13323581?
You can request a quote for BAS 13323581 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13323581?
Yes, KEHONG BIO provides custom synthesis services for BAS 13323581 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.