ChemDiv1_002942
TL;DR: ChemDiv1_002942 (CAS 312587-55-6) is a chemical compound with molecular formula C24H23ClN2O5S and molecular weight 486.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(4-chlorophenoxy)acetyl]amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
Also Known As: ChemDiv1_002942, BAS 01404334, ethyl 2-[2-(4-chlorophenoxy)acetamido]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate, ethyl 2-[[2-(4-chlorophenoxy)acetyl]amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate, ethyl 2-{[(4-chlorophenoxy)acetyl]amino}-4-methyl-5-(2-toluidinocarbonyl)-3-thiophenecarboxylate
| Molecular Formula | C24H23ClN2O5S |
|---|---|
| Molecular Weight | 486.10 g/mol |
| LogP | 5.46484 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 486.10162 |
| Heavy Atoms | 33 |
| Complexity | 1174.0978 |
Chemical Identifiers
| CAS Number | 312587-55-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)COC3=CC=C(C=C3)Cl |
Product Overview
ChemDiv1_002942 (CAS 312587-55-6), with molecular formula C24H23ClN2O5S and molecular weight 486.10 g/mol. IUPAC: ethyl 2-[[2-(4-chlorophenoxy)acetyl]amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate.
Chemical Property Profile of ChemDiv1_002942
Property Insights of ChemDiv1_002942
The XLogP value of 5.46484 indicates that ChemDiv1_002942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002942. Following Lipinski's Rule of Five, ChemDiv1_002942 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_002942?
The CAS number of ChemDiv1_002942 is 312587-55-6.
What is the molecular formula of ChemDiv1_002942?
The molecular formula of ChemDiv1_002942 is C24H23ClN2O5S.
What is the molecular weight of ChemDiv1_002942?
The molecular weight of ChemDiv1_002942 is 486.10 g/mol.
Where can I buy ChemDiv1_002942?
You can request a quote for ChemDiv1_002942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002942?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.