2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile
TL;DR: 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile (CAS 370855-09-7) is a chemical compound with molecular formula C23H20ClN3S and molecular weight 405.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile
Also Known As: 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile, 2-(butylsulfanyl)-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile, 2-(butylthio)-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile
| Molecular Formula | C23H20ClN3S |
|---|---|
| Molecular Weight | 405.11 g/mol |
| LogP | 6.23016 |
| Topological Polar Surface Area | 59.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.10666 |
| Heavy Atoms | 28 |
| Complexity | 996.49774 |
Chemical Identifiers
| CAS Number | 370855-09-7 |
|---|---|
| SMILES | CCCCSC1=C(C(C(=C(N1)C2=CC=CC=C2)C#N)C3=CC=CC=C3Cl)C#N |
Product Overview
2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile (CAS 370855-09-7), with molecular formula C23H20ClN3S and molecular weight 405.11 g/mol. IUPAC: 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile.
Chemical Property Profile of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile
Property Insights of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile
The XLogP value of 6.23016 indicates that 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.61 Ų, 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile 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 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile?
The CAS number of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile is 370855-09-7.
What is the molecular formula of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile?
The molecular formula of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile is C23H20ClN3S.
What is the molecular weight of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile?
The molecular weight of 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile is 405.11 g/mol.
Where can I buy 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile?
You can request a quote for 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-butylsulfanyl-4-(2-chlorophenyl)-6-phenyl-1,4-dihydropyridine-3,5-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.