![N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide structure](/static/products/100/100650-40-6.png)
N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide
TL;DR: N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide (CAS 100650-40-6) is a chemical compound with molecular formula C14H18N4S and molecular weight 274.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-isoquinolin-3-ylethylamino)-1,1-dimethylthiourea
Also Known As: 3-(1-isoquinolin-3-ylethylamino)-1,1-dimethylthiourea, N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide, 2-(1-(isoquinolin-3-yl)ethyl)-N,N-dimethylhydrazinecarbothioamide, 2-[1-(3-Isoquinolinyl)ethyl]-N,N-dimethylhydrazinecarbothioamide #
| Molecular Formula | C14H18N4S |
|---|---|
| Molecular Weight | 274.13 g/mol |
| LogP | 2.2365 |
| Topological Polar Surface Area | 40.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.1252 |
| Heavy Atoms | 19 |
| Complexity | 582.4226 |
Chemical Identifiers
| CAS Number | 100650-40-6 |
|---|---|
| SMILES | CC(C1=CC2=CC=CC=C2C=N1)NNC(=S)N(C)C |
Product Overview
N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide (CAS 100650-40-6), with molecular formula C14H18N4S and molecular weight 274.13 g/mol. IUPAC: 3-(1-isoquinolin-3-ylethylamino)-1,1-dimethylthiourea.
Chemical Property Profile of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide
Property Insights of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide
The XLogP value of 2.2365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide. With a topological polar surface area (TPSA) of 40.19 Ų, N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide has 2 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 N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide?
The CAS number of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide is 100650-40-6.
What is the molecular formula of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide?
The molecular formula of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide is C14H18N4S.
What is the molecular weight of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide?
The molecular weight of N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide is 274.13 g/mol.
Where can I buy N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide?
You can request a quote for N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-2-[1-[3-isoquinolyl]ethyl]hydrazinocarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.