![4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide structure](/static/products/877/877818-40-1.png)
4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide
TL;DR: 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide (CAS 877818-40-1) is a chemical compound with molecular formula C16H24N4S2 and molecular weight 336.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide
Also Known As: VU0507350-1, 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide, 4-(4-(dimethylamino)phenylcarbonothioyl)-N-ethylpiperazine-1-carbothioamide, F3005-0013
| Molecular Formula | C16H24N4S2 |
|---|---|
| Molecular Weight | 336.14 g/mol |
| LogP | 1.9401 |
| Topological Polar Surface Area | 21.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.14423 |
| Heavy Atoms | 22 |
| Complexity | 519.4523 |
Chemical Identifiers
| CAS Number | 877818-40-1 |
|---|---|
| SMILES | CCNC(=S)N1CCN(CC1)C(=S)C2=CC=C(C=C2)N(C)C |
Product Overview
4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide (CAS 877818-40-1), with molecular formula C16H24N4S2 and molecular weight 336.14 g/mol. IUPAC: 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide.
Chemical Property Profile of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide
Property Insights of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide
The XLogP value of 1.9401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 21.75 Ų, 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide has 1 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 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide?
The CAS number of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide is 877818-40-1.
What is the molecular formula of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide?
The molecular formula of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide is C16H24N4S2.
What is the molecular weight of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide?
The molecular weight of 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide is 336.14 g/mol.
Where can I buy 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide?
You can request a quote for 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(dimethylamino)benzenecarbothioyl]-N-ethylpiperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.