![3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide structure](/static/products/4535/453586-96-4.webp)
3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide
TL;DR: 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide (CAS 453586-96-4) is a chemical compound with molecular formula C13H12ClFN2OS and molecular weight 298.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]propanamide
Also Known As: 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide, 3-chloro-N-(5-(4-fluorobenzyl)thiazol-2-yl)propanamide, 3-chloro-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]propanamide, 3-chloro-N-{5-[(4-fluorophenyl)methyl](1,3-thiazol-2-yl)}propanamide
| Molecular Formula | C13H12ClFN2OS |
|---|---|
| Molecular Weight | 298.03 g/mol |
| LogP | 3.4404 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.0343 |
| Heavy Atoms | 19 |
| Complexity | 556.0258 |
Chemical Identifiers
| CAS Number | 453586-96-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=CN=C(S2)NC(=O)CCCl)F |
Product Overview
3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide (CAS 453586-96-4), with molecular formula C13H12ClFN2OS and molecular weight 298.03 g/mol. IUPAC: 3-chloro-N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]propanamide.
Chemical Property Profile of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide
Property Insights of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide
The XLogP value of 3.4404 indicates that 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide has 1 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 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide?
The CAS number of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide is 453586-96-4.
What is the molecular formula of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide?
The molecular formula of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide is C13H12ClFN2OS.
What is the molecular weight of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide?
The molecular weight of 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide is 298.03 g/mol.
Where can I buy 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide?
You can request a quote for 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-[5-(4-fluorobenzyl)-1,3-thiazol-2-yl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.