ChemDiv1_009382
TL;DR: ChemDiv1_009382 (CAS 384358-86-5) is a chemical compound with molecular formula C26H26ClN3O5S and molecular weight 527.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
Also Known As: ChemDiv1_009382, 2-methoxyethyl 4-(2-chlorophenyl)-5-cyano-6-((2-((3-methoxyphenyl)amino)-2-oxoethyl)thio)-2-methyl-1,4-dihydropyridine-3-carboxylate, F1155-0002, 2-METHOXYETHYL 4-(2-CHLOROPHENYL)-5-CYANO-6-({[(3-METHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-2-METHYL-1,4-DIHYDROPYRIDINE-3-CARBOXYLATE, 2-methoxyethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C26H26ClN3O5S |
|---|---|
| Molecular Weight | 527.13 g/mol |
| LogP | 4.60608 |
| Topological Polar Surface Area | 109.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 527.1282 |
| Heavy Atoms | 36 |
| Complexity | 1238.0806 |
Chemical Identifiers
| CAS Number | 384358-86-5 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=CC=C2)OC)C#N)C3=CC=CC=C3Cl)C(=O)OCCOC |
Product Overview
ChemDiv1_009382 (CAS 384358-86-5), with molecular formula C26H26ClN3O5S and molecular weight 527.13 g/mol. IUPAC: 2-methoxyethyl 4-(2-chlorophenyl)-5-cyano-6-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of ChemDiv1_009382
Property Insights of ChemDiv1_009382
The XLogP value of 4.60608 indicates that ChemDiv1_009382 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.68 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009382. Following Lipinski's Rule of Five, ChemDiv1_009382 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_009382?
The CAS number of ChemDiv1_009382 is 384358-86-5.
What is the molecular formula of ChemDiv1_009382?
The molecular formula of ChemDiv1_009382 is C26H26ClN3O5S.
What is the molecular weight of ChemDiv1_009382?
The molecular weight of ChemDiv1_009382 is 527.13 g/mol.
Where can I buy ChemDiv1_009382?
You can request a quote for ChemDiv1_009382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009382?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.