ML162
TL;DR: ML162 (CAS 1035072-16-2) is a chemical compound with molecular formula C23H22Cl2N2O3S and molecular weight 476.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloro-N-(2-chloroacetyl)-4-methoxyanilino)-N-(2-phenylethyl)-2-thiophen-2-ylacetamide
Also Known As: s4452, 2-[(chloroacetyl)(3-chloro-4-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide, J3.022.654B, 2-(3-chloro-N-(2-chloroacetyl)-4-methoxyanilino)-N-(2-phenylethyl)-2-thiophen-2-ylacetamide, 2-chloro-N-(3-chloro-4-methoxyphenyl)-N-(2-oxo-2-(phenethylamino)-1-(thiophen-2-yl)ethyl)acetamide
| Molecular Formula | C23H22Cl2N2O3S |
|---|---|
| Molecular Weight | 476.07 g/mol |
| LogP | 5.0821 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 476.0728 |
| Heavy Atoms | 31 |
| Complexity | 1012.9258 |
Chemical Identifiers
| CAS Number | 1035072-16-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)N(C(C2=CC=CS2)C(=O)NCCC3=CC=CC=C3)C(=O)CCl)Cl |
Product Overview
ML162 (CAS 1035072-16-2), with molecular formula C23H22Cl2N2O3S and molecular weight 476.07 g/mol. IUPAC: 2-(3-chloro-N-(2-chloroacetyl)-4-methoxyanilino)-N-(2-phenylethyl)-2-thiophen-2-ylacetamide.
Chemical Property Profile of ML162
Property Insights of ML162
The XLogP value of 5.0821 indicates that ML162 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, ML162 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ML162 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ML162?
The CAS number of ML162 is 1035072-16-2.
What is the molecular formula of ML162?
The molecular formula of ML162 is C23H22Cl2N2O3S.
What is the molecular weight of ML162?
The molecular weight of ML162 is 476.07 g/mol.
Where can I buy ML162?
You can request a quote for ML162 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ML162?
Yes, KEHONG BIO provides custom synthesis services for ML162 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.