4-(dimethylamino)-N-methylbenzenecarbothioamide
TL;DR: 4-(dimethylamino)-N-methylbenzenecarbothioamide (CAS 21176-93-2) is a chemical compound with molecular formula C10H14N2S and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylamino)-N-methylbenzenecarbothioamide
Also Known As: 4-(dimethylamino)-N-methylbenzenecarbothioamide, Benzenecarbothioamide, 4-(dimethylamino)-N-methyl-, AB01333856-02, [4-(dimethylamino)phenyl](methylamino)methane-1-thione, A4133/0176260
| Molecular Formula | C10H14N2S |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 1.6475 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.08777 |
| Heavy Atoms | 13 |
| Complexity | 290.29797 |
Chemical Identifiers
| CAS Number | 21176-93-2 |
|---|---|
| SMILES | CNC(=S)C1=CC=C(C=C1)N(C)C |
Product Overview
4-(dimethylamino)-N-methylbenzenecarbothioamide (CAS 21176-93-2), with molecular formula C10H14N2S and molecular weight 194.09 g/mol. IUPAC: 4-(dimethylamino)-N-methylbenzenecarbothioamide.
Chemical Property Profile of 4-(dimethylamino)-N-methylbenzenecarbothioamide
Property Insights of 4-(dimethylamino)-N-methylbenzenecarbothioamide
The XLogP value of 1.6475 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(dimethylamino)-N-methylbenzenecarbothioamide. With a topological polar surface area (TPSA) of 15.27 Ų, 4-(dimethylamino)-N-methylbenzenecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(dimethylamino)-N-methylbenzenecarbothioamide 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-(dimethylamino)-N-methylbenzenecarbothioamide?
The CAS number of 4-(dimethylamino)-N-methylbenzenecarbothioamide is 21176-93-2.
What is the molecular formula of 4-(dimethylamino)-N-methylbenzenecarbothioamide?
The molecular formula of 4-(dimethylamino)-N-methylbenzenecarbothioamide is C10H14N2S.
What is the molecular weight of 4-(dimethylamino)-N-methylbenzenecarbothioamide?
The molecular weight of 4-(dimethylamino)-N-methylbenzenecarbothioamide is 194.09 g/mol.
Where can I buy 4-(dimethylamino)-N-methylbenzenecarbothioamide?
You can request a quote for 4-(dimethylamino)-N-methylbenzenecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(dimethylamino)-N-methylbenzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(dimethylamino)-N-methylbenzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.