ChemDiv1_027884
TL;DR: ChemDiv1_027884 (CAS 374917-85-8) is a chemical compound with molecular formula C29H27N5O3S and molecular weight 525.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-6-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: ChemDiv1_027884, 5-cyano-6-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide, 2-[3-cyano-6-methyl-5-(N-phenylcarbamoyl)-4-(4-pyridyl)(2-1,4-dihydropyridylth io)]-N-(4-ethoxyphenyl)acetamide, 5-cyano-6-((2-((4-ethoxyphenyl)amino)-2-oxoethyl)thio)-2-methyl-N-phenyl-1,4-dihydro-[4,4'-bipyridine]-3-carboxamide, 5-CYANO-6-({[(4-ETHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-2-METHYL-N-PHENYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-3-CARBOXAMIDE
| Molecular Formula | C29H27N5O3S |
|---|---|
| Molecular Weight | 525.18 g/mol |
| LogP | 5.18688 |
| Topological Polar Surface Area | 116.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 525.1835 |
| Heavy Atoms | 38 |
| Complexity | 1397.636 |
Chemical Identifiers
| CAS Number | 374917-85-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=NC=C4)C#N |
Product Overview
ChemDiv1_027884 (CAS 374917-85-8), with molecular formula C29H27N5O3S and molecular weight 525.18 g/mol. IUPAC: 5-cyano-6-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of ChemDiv1_027884
Property Insights of ChemDiv1_027884
The XLogP value of 5.18688 indicates that ChemDiv1_027884 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.14 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_027884. Following Lipinski's Rule of Five, ChemDiv1_027884 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_027884?
The CAS number of ChemDiv1_027884 is 374917-85-8.
What is the molecular formula of ChemDiv1_027884?
The molecular formula of ChemDiv1_027884 is C29H27N5O3S.
What is the molecular weight of ChemDiv1_027884?
The molecular weight of ChemDiv1_027884 is 525.18 g/mol.
Where can I buy ChemDiv1_027884?
You can request a quote for ChemDiv1_027884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_027884?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_027884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.