propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate structure

propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate

TL;DR: propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate (CAS 522593-95-9) is a chemical compound with molecular formula C20H24ClNO3S and molecular weight 393.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

propyl 2-[(2-chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)thiophene-3-carboxylate

Also Known As: propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate, propyl 2-[(2-chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)thiophene-3-carboxylate, propyl 2-(2-chloroacetylamino)-5-methyl-4-(4-propylphenyl)thiophene-3-carboxyl ate, propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)thiophene-3-carboxylate

CAS: 522593-95-9
Molecular Formula C20H24ClNO3S
Molecular Weight 393.12 g/mol
LogP 5.42012
Topological Polar Surface Area 55.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 8
Exact Mass 393.11655
Heavy Atoms 26
Complexity 768.10864

Chemical Identifiers

CAS Number 522593-95-9
SMILES CCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCCC)NC(=O)CCl)C

Product Overview

propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate (CAS 522593-95-9), with molecular formula C20H24ClNO3S and molecular weight 393.12 g/mol. IUPAC: propyl 2-[(2-chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)thiophene-3-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate

XLogP
5.42012
TPSA (Topological Polar Surface Area)
55.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
8
Heavy Atoms
26
Complexity
768.10864
Exact Mass
393.11655
Monoisotopic Mass
393.11655
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate

The XLogP value of 5.42012 indicates that propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate?

The CAS number of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate is 522593-95-9.

What is the molecular formula of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate?

The molecular formula of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate is C20H24ClNO3S.

What is the molecular weight of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate?

The molecular weight of propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate is 393.12 g/mol.

Where can I buy propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate?

You can request a quote for propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate?

Yes, KEHONG BIO provides custom synthesis services for propyl 2-[(chloroacetyl)amino]-5-methyl-4-(4-propylphenyl)-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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