Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate
TL;DR: Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate (CAS 701952-15-0) is a chemical compound with molecular formula C13H14N6O4S2 and molecular weight 382.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]carbamate
Also Known As: methyl N-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]carbamate, methoxy-N-{[({4-[(pyrimidin-2-ylamino)sulfonyl]phenyl}amino)thioxomethyl]amino }carboxamide, methyl 2-((4-(N-(pyrimidin-2-yl)sulfamoyl)phenyl)carbamothioyl)hydrazinecarboxylate, methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate
| Molecular Formula | C13H14N6O4S2 |
|---|---|
| Molecular Weight | 382.05 g/mol |
| LogP | 0.8348 |
| Topological Polar Surface Area | 134.34 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.0518 |
| Heavy Atoms | 25 |
| Complexity | 842.58276 |
Chemical Identifiers
| CAS Number | 701952-15-0 |
|---|---|
| SMILES | COC(=O)NNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2 |
Product Overview
Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate (CAS 701952-15-0), with molecular formula C13H14N6O4S2 and molecular weight 382.05 g/mol. IUPAC: methyl N-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioylamino]carbamate.
Chemical Property Profile of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate
Property Insights of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate
The XLogP value of 0.8348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate. The TPSA of 134.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate. Following Lipinski's Rule of Five, Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate has 4 hydrogen bond donor(s) and 7 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 Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate?
The CAS number of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate is 701952-15-0.
What is the molecular formula of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate?
The molecular formula of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate is C13H14N6O4S2.
What is the molecular weight of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate?
The molecular weight of Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate is 382.05 g/mol.
Where can I buy Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate?
You can request a quote for Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamothioyl}hydrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.