4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide
TL;DR: 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide (CAS 21176-96-5) is a chemical compound with molecular formula C11H16N2S and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylamino)-N,N-dimethylbenzenecarbothioamide
Also Known As: 4-(dimethylamino)-N,N-dimethylbenzenecarbothioamide, N,N-dimethyl-p-(dimethylamino)thiobenzamide, Benzenecarbothioamide, 4-(dimethylamino)-N,N-dimethyl-, 4-(dimethylamino)-N,N-dimethylbenzene-1-carbothioamide, (dimethylamino)[4-(dimethylamino)phenyl]methane-1-thione
| Molecular Formula | C11H16N2S |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 1.9897 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10342 |
| Heavy Atoms | 14 |
| Complexity | 314.56433 |
Chemical Identifiers
| CAS Number | 21176-96-5 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=S)N(C)C |
Product Overview
4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide (CAS 21176-96-5), with molecular formula C11H16N2S and molecular weight 208.10 g/mol. IUPAC: 4-(dimethylamino)-N,N-dimethylbenzenecarbothioamide.
Chemical Property Profile of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide
Property Insights of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide
The XLogP value of 1.9897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide. With a topological polar surface area (TPSA) of 6.48 Ų, 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide has 0 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,N-dimethylbenzenecarbothioamide?
The CAS number of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide is 21176-96-5.
What is the molecular formula of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide?
The molecular formula of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide is C11H16N2S.
What is the molecular weight of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide?
The molecular weight of 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide is 208.10 g/mol.
Where can I buy 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide?
You can request a quote for 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide 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,N-dimethylbenzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(Dimethylamino)-N,N-dimethylbenzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.