BAS 00286697
TL;DR: BAS 00286697 (CAS 330580-24-0) is a chemical compound with molecular formula C20H18N4O4S2 and molecular weight 442.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-phenylprop-2-enamide
Also Known As: BAS 00286697, (2E)-N-({4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}carbamothioyl)-3-phenylprop-2-enamide, F1443-3102, N-((4-(N-(5-methylisoxazol-3-yl)sulfamoyl)phenyl)carbamothioyl)cinnamamide, (E)-N-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-phenylprop-2-enamide
| Molecular Formula | C20H18N4O4S2 |
|---|---|
| Molecular Weight | 442.08 g/mol |
| LogP | 3.31022 |
| Topological Polar Surface Area | 113.33 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.07693 |
| Heavy Atoms | 30 |
| Complexity | 1171.0303 |
Chemical Identifiers
| CAS Number | 330580-24-0 |
|---|---|
| SMILES | CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=CC=C3 |
Product Overview
BAS 00286697 (CAS 330580-24-0), with molecular formula C20H18N4O4S2 and molecular weight 442.08 g/mol. IUPAC: (E)-N-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-phenylprop-2-enamide.
Chemical Property Profile of BAS 00286697
Property Insights of BAS 00286697
The XLogP value of 3.31022 indicates that BAS 00286697 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.33 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00286697. Following Lipinski's Rule of Five, BAS 00286697 has 3 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 00286697?
The CAS number of BAS 00286697 is 330580-24-0.
What is the molecular formula of BAS 00286697?
The molecular formula of BAS 00286697 is C20H18N4O4S2.
What is the molecular weight of BAS 00286697?
The molecular weight of BAS 00286697 is 442.08 g/mol.
Where can I buy BAS 00286697?
You can request a quote for BAS 00286697 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00286697?
Yes, KEHONG BIO provides custom synthesis services for BAS 00286697 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.