BAS 00286664
TL;DR: BAS 00286664 (CAS 330580-17-1) is a chemical compound with molecular formula C18H16N4O4S3 and molecular weight 448.03336 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide
Also Known As: BAS 00286664, (2E)-N-({4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}carbamothioyl)-3-(thiophen-2-yl)prop-2-enamide, (E)-N-((4-(N-(5-methylisoxazol-3-yl)sulfamoyl)phenyl)carbamothioyl)-3-(thiophen-2-yl)acrylamide, (E)-N-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide
Technical Specifications
| Molecular Formula | C18H16N4O4S3 |
| Molecular Weight | 448.03336 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 182.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.03336 Da |
| Heavy Atoms | 29 |
| Complexity | 717.0 |
| SMILES | CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=CS3 |
| InChIKey | JGFJANNMCMOEBL-RMKNXTFCSA-N |
Chemical Property Profile of BAS 00286664
Property Insights of BAS 00286664
The XLogP value of 3.4 indicates that BAS 00286664 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 182.0 Ų indicates high polarity, suggesting BAS 00286664 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00286664 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 00286664?
The CAS number of BAS 00286664 is 330580-17-1.
What is the molecular formula of BAS 00286664?
The molecular formula of BAS 00286664 is C18H16N4O4S3.
What is the molecular weight of BAS 00286664?
The molecular weight of BAS 00286664 is 448.03336 g/mol.
Where can I buy BAS 00286664?
You can request a quote for BAS 00286664 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 00286664?
Yes, CoreyChem provides custom synthesis services for BAS 00286664 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.