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2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide
TL;DR: 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide (CAS 116850-74-9) is a chemical compound with molecular formula C7H9N3OS2 and molecular weight 215.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(thiophene-2-carbonylamino)thiourea
Also Known As: Maybridge1_004571, N-methyl-2-(2-thienylcarbonyl)hydrazinecarbothioamide, 1-(2-Thenoyl)-4-methylthiosemicarbazide, 1-methyl-3-(thiophene-2-carbonylamino)thiourea, N-Methyl-2-(thiophene-2-carbonyl)hydrazinecarbothioamide
| Molecular Formula | C7H9N3OS2 |
|---|---|
| Molecular Weight | 215.02 g/mol |
| LogP | 0.4868 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.0187 |
| Heavy Atoms | 13 |
| Complexity | 296.6961 |
Chemical Identifiers
| CAS Number | 116850-74-9 |
|---|---|
| SMILES | CNC(=S)NNC(=O)C1=CC=CS1 |
Product Overview
2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide (CAS 116850-74-9), with molecular formula C7H9N3OS2 and molecular weight 215.02 g/mol. IUPAC: 1-methyl-3-(thiophene-2-carbonylamino)thiourea.
Chemical Property Profile of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide
Property Insights of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide
The XLogP value of 0.4868 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide. With a topological polar surface area (TPSA) of 53.16 Ų, 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide has 3 hydrogen bond donor(s) and 3 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-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide?
The CAS number of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide is 116850-74-9.
What is the molecular formula of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide?
The molecular formula of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide is C7H9N3OS2.
What is the molecular weight of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide?
The molecular weight of 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide is 215.02 g/mol.
Where can I buy 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide?
You can request a quote for 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiophenecarboxylic acid, 2-[(methylamino)thioxomethyl]hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.