RefChem:1068849
TL;DR: RefChem:1068849 (CAS 145865-83-4) is a chemical compound with molecular formula C13H12N2O4S2 and molecular weight 324.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(E)-benzylideneamino]sulfamoyl]thiophene-3-carboxylate
Also Known As: Methyl 4-(((phenylmethylene)hydrazino)sulfonyl)-3-thiophenecarboxylate, 3-Thiophenecarboxylic acid, 4-(((phenylmethylene)hydrazino)sulfonyl)-, methyl ester, methyl 4-[N'-(phenylmethylidene)hydrazinesulfonyl]thiophene-3-carboxylate, 4-[[2-(Benzylidene)hydrazino]sulfonyl]thiophene-3-carboxylic acid methyl ester, RefChem:1068849
| Molecular Formula | C13H12N2O4S2 |
|---|---|
| Molecular Weight | 324.02 g/mol |
| LogP | 1.8471 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.02383 |
| Heavy Atoms | 21 |
| Complexity | 751.4883 |
Chemical Identifiers
| CAS Number | 145865-83-4 |
|---|---|
| SMILES | COC(=O)C1=CSC=C1S(=O)(=O)N/N=C/C2=CC=CC=C2 |
Product Overview
RefChem:1068849 (CAS 145865-83-4), with molecular formula C13H12N2O4S2 and molecular weight 324.02 g/mol. IUPAC: methyl 4-[[(E)-benzylideneamino]sulfamoyl]thiophene-3-carboxylate.
Chemical Property Profile of RefChem:1068849
Property Insights of RefChem:1068849
The XLogP value of 1.8471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1068849. The TPSA of 84.83 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1068849. Following Lipinski's Rule of Five, RefChem:1068849 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 RefChem:1068849?
The CAS number of RefChem:1068849 is 145865-83-4.
What is the molecular formula of RefChem:1068849?
The molecular formula of RefChem:1068849 is C13H12N2O4S2.
What is the molecular weight of RefChem:1068849?
The molecular weight of RefChem:1068849 is 324.02 g/mol.
Where can I buy RefChem:1068849?
You can request a quote for RefChem:1068849 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1068849?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1068849 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.