4-chloro-N-methylbenzenecarbothiohydrazide
TL;DR: 4-chloro-N-methylbenzenecarbothiohydrazide (CAS 5430-56-8) is a chemical compound with molecular formula C8H9ClN2S and molecular weight 200.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-methylbenzenecarbothiohydrazide
Also Known As: 4-chloro-n-methylbenzenecarbothiohydrazide, 7-methoxy-1H-isochromen-4(3H)-one, 4-chloro-thiobenzoic acid N-methyl-hydrazide, 4-Chloro-n-methyl-benzenecarbothiohydrazide, 4-Chloro-N-methylbenzene-1-carbothiohydrazide
| Molecular Formula | C8H9ClN2S |
|---|---|
| Molecular Weight | 200.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.0175 |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 5430-56-8 |
|---|---|
| SMILES | CN(C(=S)C1=CC=C(C=C1)Cl)N |
| InChIKey | JRPUDQYDUGTQHN-UHFFFAOYSA-N |
Product Overview
4-chloro-N-methylbenzenecarbothiohydrazide (CAS 5430-56-8), with molecular formula C8H9ClN2S and molecular weight 200.02 g/mol. IUPAC: 4-chloro-N-methylbenzenecarbothiohydrazide.
Chemical Property Profile of 4-chloro-N-methylbenzenecarbothiohydrazide
Property Insights of 4-chloro-N-methylbenzenecarbothiohydrazide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-methylbenzenecarbothiohydrazide. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-methylbenzenecarbothiohydrazide. Following Lipinski's Rule of Five, 4-chloro-N-methylbenzenecarbothiohydrazide has 1 hydrogen bond donor(s) and 2 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 4-chloro-N-methylbenzenecarbothiohydrazide?
The CAS number of 4-chloro-N-methylbenzenecarbothiohydrazide is 5430-56-8.
What is the molecular formula of 4-chloro-N-methylbenzenecarbothiohydrazide?
The molecular formula of 4-chloro-N-methylbenzenecarbothiohydrazide is C8H9ClN2S.
What is the molecular weight of 4-chloro-N-methylbenzenecarbothiohydrazide?
The molecular weight of 4-chloro-N-methylbenzenecarbothiohydrazide is 200.02 g/mol.
Where can I buy 4-chloro-N-methylbenzenecarbothiohydrazide?
You can request a quote for 4-chloro-N-methylbenzenecarbothiohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-methylbenzenecarbothiohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-methylbenzenecarbothiohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.