RefChem:1068845
TL;DR: RefChem:1068845 (CAS 145865-84-5) is a chemical compound with molecular formula C13H11ClN2O4S2 and molecular weight 357.98486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[[(E)-(4-chlorophenyl)methylideneamino]sulfamoyl]thiophene-3-carboxylate
Also Known As: Methyl 4-((((4-chlorophenyl)methylene)hydrazino)sulfonyl)-3-thiophenecarboxylate, 3-Thiophenecarboxylic acid, 4-((((4-chlorophenyl)methylene)hydrazino)sulfonyl)-, methyl ester, 4-[[2-(4-Chlorobenzylidene)hydrazino]sulfonyl]thiophene-3-carboxylic acid methyl ester, methyl 4-{N'-[(4-chlorophenyl)methylidene]hydrazinesulfonyl}thiophene-3-carboxylate
Technical Specifications
| Molecular Formula | C13H11ClN2O4S2 |
| Molecular Weight | 357.98486 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.98486 Da |
| Heavy Atoms | 22 |
| Complexity | 513.0 |
| SMILES | COC(=O)C1=CSC=C1S(=O)(=O)N/N=C/C2=CC=C(C=C2)Cl |
| InChIKey | FXGOQGIZNKQJCP-GIDUJCDVSA-N |
Chemical Property Profile of RefChem:1068845
Property Insights of RefChem:1068845
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068845. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1068845. Following Lipinski's Rule of Five, RefChem:1068845 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1068845?
The CAS number of RefChem:1068845 is 145865-84-5.
What is the molecular formula of RefChem:1068845?
The molecular formula of RefChem:1068845 is C13H11ClN2O4S2.
What is the molecular weight of RefChem:1068845?
The molecular weight of RefChem:1068845 is 357.98486 g/mol.
Where can I buy RefChem:1068845?
You can request a quote for RefChem:1068845 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1068845?
Yes, CoreyChem provides custom synthesis services for RefChem:1068845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.