![4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide structure](/static/products/7082/708229-98-5.webp)
4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide
TL;DR: 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide (CAS 708229-98-5) is a chemical compound with molecular formula C15H21Cl2N3S and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide
Also Known As: 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide, 4-(2,6-dichlorobenzyl)-N-(propan-2-yl)piperazine-1-carbothioamide, 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-yl-piperazine-1-carbothioamide, 4-(2,6-DICHLOROBENZYL)-N-ISOPROPYLTETRAHYDRO-1(2H)-PYRAZINECARBOTHIOAMIDE
| Molecular Formula | C15H21Cl2N3S |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 3.3939 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.0833 |
| Heavy Atoms | 21 |
| Complexity | 479.44214 |
Chemical Identifiers
| CAS Number | 708229-98-5 |
|---|---|
| SMILES | CC(C)NC(=S)N1CCN(CC1)CC2=C(C=CC=C2Cl)Cl |
Product Overview
4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide (CAS 708229-98-5), with molecular formula C15H21Cl2N3S and molecular weight 345.08 g/mol. IUPAC: 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide.
Chemical Property Profile of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide
Property Insights of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide
The XLogP value of 3.3939 indicates that 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide has 1 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-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide?
The CAS number of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide is 708229-98-5.
What is the molecular formula of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide?
The molecular formula of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide is C15H21Cl2N3S.
What is the molecular weight of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide?
The molecular weight of 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide is 345.08 g/mol.
Where can I buy 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide?
You can request a quote for 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-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-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,6-dichlorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.