N-(dimethylaminomethylidene)benzenecarbothioamide
TL;DR: N-(dimethylaminomethylidene)benzenecarbothioamide (CAS 52421-65-5) is a chemical compound with molecular formula C10H12N2S and molecular weight 192.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(dimethylaminomethylidene)benzenecarbothioamide
Also Known As: N-(dimethylaminomethylidene)benzenecarbothioamide, N-(Dimethylaminomethylene)thiobenzamide, (E)-N-((Dimethylamino)methylene)benzothioamide, ((dimethylamino)methylene)benzothioamide, N-(Dimethylaminomethylene)benzothioamide
| Molecular Formula | C10H12N2S |
|---|---|
| Molecular Weight | 192.07 g/mol |
| LogP | 1.952 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.07211 |
| Heavy Atoms | 13 |
| Complexity | 303.9606 |
Chemical Identifiers
| CAS Number | 52421-65-5 |
|---|---|
| SMILES | CN(C)C=NC(=S)C1=CC=CC=C1 |
Product Overview
N-(dimethylaminomethylidene)benzenecarbothioamide (CAS 52421-65-5), with molecular formula C10H12N2S and molecular weight 192.07 g/mol. IUPAC: N-(dimethylaminomethylidene)benzenecarbothioamide.
Chemical Property Profile of N-(dimethylaminomethylidene)benzenecarbothioamide
Property Insights of N-(dimethylaminomethylidene)benzenecarbothioamide
The XLogP value of 1.952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(dimethylaminomethylidene)benzenecarbothioamide. With a topological polar surface area (TPSA) of 15.6 Ų, N-(dimethylaminomethylidene)benzenecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(dimethylaminomethylidene)benzenecarbothioamide has 0 hydrogen bond donor(s) and 1 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 N-(dimethylaminomethylidene)benzenecarbothioamide?
The CAS number of N-(dimethylaminomethylidene)benzenecarbothioamide is 52421-65-5.
What is the molecular formula of N-(dimethylaminomethylidene)benzenecarbothioamide?
The molecular formula of N-(dimethylaminomethylidene)benzenecarbothioamide is C10H12N2S.
What is the molecular weight of N-(dimethylaminomethylidene)benzenecarbothioamide?
The molecular weight of N-(dimethylaminomethylidene)benzenecarbothioamide is 192.07 g/mol.
Where can I buy N-(dimethylaminomethylidene)benzenecarbothioamide?
You can request a quote for N-(dimethylaminomethylidene)benzenecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(dimethylaminomethylidene)benzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(dimethylaminomethylidene)benzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.