![N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide structure](/static/products/4431/443125-80-2.webp)
N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide
TL;DR: N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide (CAS 443125-80-2) is a chemical compound with molecular formula C22H20ClN3OS and molecular weight 409.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide
Also Known As: N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide, AN-023/40810544, N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-N'-(2-naphthoyl)thiourea, N-((3-chloro-4-(pyrrolidin-1-yl)phenyl)carbamothioyl)-2-naphthamide, N-{[3-chloro-4-(pyrrolidin-1-yl)phenyl]carbamothioyl}naphthalene-2-carboxamide
| Molecular Formula | C22H20ClN3OS |
|---|---|
| Molecular Weight | 409.10 g/mol |
| LogP | 5.2202 |
| Topological Polar Surface Area | 44.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.10156 |
| Heavy Atoms | 28 |
| Complexity | 1046.8862 |
Chemical Identifiers
| CAS Number | 443125-80-2 |
|---|---|
| SMILES | C1CCN(C1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C=C3)Cl |
Product Overview
N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide (CAS 443125-80-2), with molecular formula C22H20ClN3OS and molecular weight 409.10 g/mol. IUPAC: N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide.
Chemical Property Profile of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide
Property Insights of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide
The XLogP value of 5.2202 indicates that N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.37 Ų, N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide 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 N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide?
The CAS number of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide is 443125-80-2.
What is the molecular formula of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide?
The molecular formula of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide is C22H20ClN3OS.
What is the molecular weight of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide?
The molecular weight of N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide is 409.10 g/mol.
Where can I buy N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide?
You can request a quote for N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.