2-(2,6-Dimethylphenyl)hydrazinecarbothioamide
TL;DR: 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide (CAS 71058-35-0) is a chemical compound with molecular formula C9H13N3S and molecular weight 195.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dimethylanilino)thiourea
Also Known As: (2,6-dimethylanilino)thiourea, 2-(2,6-dimethylphenyl)hydrazinecarbothioamide, N-(2,6-DIMETHYLPHENYL) THIOSEMICARBAZIDE, 2,5-DIMETHYL-1,2-DIHYDRO-PYRAZOL-3-ONE, AS-662/40210445
| Molecular Formula | C9H13N3S |
|---|---|
| Molecular Weight | 195.08 g/mol |
| LogP | 1.46354 |
| Topological Polar Surface Area | 50.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.08302 |
| Heavy Atoms | 13 |
| Complexity | 302.3859 |
Chemical Identifiers
| CAS Number | 71058-35-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NNC(=S)N |
Product Overview
2-(2,6-Dimethylphenyl)hydrazinecarbothioamide (CAS 71058-35-0), with molecular formula C9H13N3S and molecular weight 195.08 g/mol. IUPAC: (2,6-dimethylanilino)thiourea.
Chemical Property Profile of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide
Property Insights of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide
The XLogP value of 1.46354 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide. With a topological polar surface area (TPSA) of 50.08 Ų, 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide has 3 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 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide?
The CAS number of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide is 71058-35-0.
What is the molecular formula of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide?
The molecular formula of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide is C9H13N3S.
What is the molecular weight of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide?
The molecular weight of 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide is 195.08 g/mol.
Where can I buy 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide?
You can request a quote for 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,6-Dimethylphenyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.