ChemDiv1_005683
TL;DR: ChemDiv1_005683 (CAS 297157-98-3) is a chemical compound with molecular formula C25H25ClN2O5S and molecular weight 500.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-[[2-(4-methoxyphenyl)acetyl]amino]-4-methylthiophene-3-carboxylate
Also Known As: ChemDiv1_005683, BIM-0047843.P001, F0850-4625, ETHYL 5-[(3-CHLORO-4-METHYLPHENYL)CARBAMOYL]-2-[2-(4-METHOXYPHENYL)ACETAMIDO]-4-METHYLTHIOPHENE-3-CARBOXYLATE, A2298/0096842
| Molecular Formula | C25H25ClN2O5S |
|---|---|
| Molecular Weight | 500.12 g/mol |
| LogP | 5.63714 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 500.11728 |
| Heavy Atoms | 34 |
| Complexity | 1220.7891 |
Chemical Identifiers
| CAS Number | 297157-98-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=C(C=C2)C)Cl)NC(=O)CC3=CC=C(C=C3)OC |
Product Overview
ChemDiv1_005683 (CAS 297157-98-3), with molecular formula C25H25ClN2O5S and molecular weight 500.12 g/mol. IUPAC: ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-2-[[2-(4-methoxyphenyl)acetyl]amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of ChemDiv1_005683
Property Insights of ChemDiv1_005683
The XLogP value of 5.63714 indicates that ChemDiv1_005683 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_005683. Following Lipinski's Rule of Five, ChemDiv1_005683 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_005683?
The CAS number of ChemDiv1_005683 is 297157-98-3.
What is the molecular formula of ChemDiv1_005683?
The molecular formula of ChemDiv1_005683 is C25H25ClN2O5S.
What is the molecular weight of ChemDiv1_005683?
The molecular weight of ChemDiv1_005683 is 500.12 g/mol.
Where can I buy ChemDiv1_005683?
You can request a quote for ChemDiv1_005683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005683?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.