![2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide structure](/static/products/4454/445416-92-2.webp)
2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide
TL;DR: 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide (CAS 445416-92-2) is a chemical compound with molecular formula C20H21Cl2N3OS and molecular weight 421.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide
Also Known As: AN-465/41161707, 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide, 2-chloro-N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-4-methylbenzamide, N-(2-chloro-4-methylbenzoyl)-N'-[3-chloro-4-(1-piperidinyl)phenyl]thiourea
| Molecular Formula | C20H21Cl2N3OS |
|---|---|
| Molecular Weight | 421.08 g/mol |
| LogP | 5.41892 |
| Topological Polar Surface Area | 44.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.07825 |
| Heavy Atoms | 27 |
| Complexity | 866.3005 |
Chemical Identifiers
| CAS Number | 445416-92-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl)Cl |
Product Overview
2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide (CAS 445416-92-2), with molecular formula C20H21Cl2N3OS and molecular weight 421.08 g/mol. IUPAC: 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide.
Chemical Property Profile of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide
Property Insights of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide
The XLogP value of 5.41892 indicates that 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.37 Ų, 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide?
The CAS number of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide is 445416-92-2.
What is the molecular formula of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide?
The molecular formula of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide is C20H21Cl2N3OS.
What is the molecular weight of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide?
The molecular weight of 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide is 421.08 g/mol.
Where can I buy 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide?
You can request a quote for 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.