![4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide structure](/static/products/951/951980-10-2.png)
4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide
TL;DR: 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide (CAS 951980-10-2) is a chemical compound with molecular formula C19H29ClN4OS and molecular weight 396.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-chlorophenyl)methyl]-N-(3-morpholin-4-ylpropyl)piperazine-1-carbothioamide
Also Known As: 4-[(3-chlorophenyl)methyl]-N-(3-morpholin-4-ylpropyl)piperazine-1-carbothioamide, 4-(3-chlorobenzyl)-N-(3-morpholinopropyl)piperazine-1-carbothioamide, 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide
| Molecular Formula | C19H29ClN4OS |
|---|---|
| Molecular Weight | 396.18 g/mol |
| LogP | 2.0544 |
| Topological Polar Surface Area | 30.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.17505 |
| Heavy Atoms | 26 |
| Complexity | 574.4125 |
Chemical Identifiers
| CAS Number | 951980-10-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=S)NCCCN3CCOCC3 |
Product Overview
4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide (CAS 951980-10-2), with molecular formula C19H29ClN4OS and molecular weight 396.18 g/mol. IUPAC: 4-[(3-chlorophenyl)methyl]-N-(3-morpholin-4-ylpropyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide
Property Insights of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide
The XLogP value of 2.0544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 30.98 Ų, 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 4 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-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide?
The CAS number of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide is 951980-10-2.
What is the molecular formula of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide?
The molecular formula of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide is C19H29ClN4OS.
What is the molecular weight of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide?
The molecular weight of 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide is 396.18 g/mol.
Where can I buy 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide?
You can request a quote for 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-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-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-chlorobenzyl)-N-[3-(morpholin-4-yl)propyl]piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.