2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide
TL;DR: 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide (CAS 339017-97-9) is a chemical compound with molecular formula C12H12ClN5OS and molecular weight 309.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6-chloro-2-methylsulfanylpyrimidin-4-yl)amino]-3-phenylurea
Also Known As: 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide, 1-[(6-chloro-2-methylsulfanylpyrimidin-4-yl)amino]-3-phenylurea, 3-{[6-chloro-2-(methylsulfanyl)pyrimidin-4-yl]amino}-1-phenylurea, 2-(6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl)-N-phenyl-1-hydrazinecarboxamide, 1-[(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)amino]-3-phenyl-urea
| Molecular Formula | C12H12ClN5OS |
|---|---|
| Molecular Weight | 309.05 g/mol |
| LogP | 3.0005 |
| Topological Polar Surface Area | 78.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.0451 |
| Heavy Atoms | 20 |
| Complexity | 595.6565 |
Chemical Identifiers
| CAS Number | 339017-97-9 |
|---|---|
| SMILES | CSC1=NC(=CC(=N1)Cl)NNC(=O)NC2=CC=CC=C2 |
Product Overview
2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide (CAS 339017-97-9), with molecular formula C12H12ClN5OS and molecular weight 309.05 g/mol. IUPAC: 1-[(6-chloro-2-methylsulfanylpyrimidin-4-yl)amino]-3-phenylurea.
Chemical Property Profile of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide
Property Insights of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide
The XLogP value of 3.0005 indicates that 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide. Following Lipinski's Rule of Five, 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide has 3 hydrogen bond donor(s) and 5 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 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide?
The CAS number of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide is 339017-97-9.
What is the molecular formula of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide?
The molecular formula of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide is C12H12ClN5OS.
What is the molecular weight of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide?
The molecular weight of 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide is 309.05 g/mol.
Where can I buy 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide?
You can request a quote for 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[6-chloro-2-(methylsulfanyl)-4-pyrimidinyl]-N-phenyl-1-hydrazinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.