![N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide structure](/static/products/736/736954-67-9.png)
N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide
TL;DR: N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide (CAS 736954-67-9) is a chemical compound with molecular formula C21H18ClN3O2S and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide
Also Known As: N-((2-chloro-5-propionamidophenyl)carbamothioyl)-1-naphthamide, N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide, N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide
| Molecular Formula | C21H18ClN3O2S |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 4.9685 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.0808 |
| Heavy Atoms | 28 |
| Complexity | 1063.205 |
Chemical Identifiers
| CAS Number | 736954-67-9 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32 |
Product Overview
N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide (CAS 736954-67-9), with molecular formula C21H18ClN3O2S and molecular weight 411.08 g/mol. IUPAC: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide.
Chemical Property Profile of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide
Property Insights of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide
The XLogP value of 4.9685 indicates that N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide. Following Lipinski's Rule of Five, N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide has 3 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 N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide?
The CAS number of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide is 736954-67-9.
What is the molecular formula of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide?
The molecular formula of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide is C21H18ClN3O2S.
What is the molecular weight of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide?
The molecular weight of N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide is 411.08 g/mol.
Where can I buy N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide?
You can request a quote for N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}naphthalene-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.