VU0507415-1
TL;DR: VU0507415-1 (CAS 780792-83-8) is a chemical compound with molecular formula C23H20FN3O4S and molecular weight 453.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Also Known As: VU0507415-1, F3009-1559, allyl 5-cyano-6-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate, prop-2-en-1-yl 5-cyano-6-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate, prop-2-enyl 5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C23H20FN3O4S |
|---|---|
| Molecular Weight | 453.12 g/mol |
| LogP | 4.21578 |
| Topological Polar Surface Area | 104.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.11584 |
| Heavy Atoms | 32 |
| Complexity | 1115.1104 |
Chemical Identifiers
| CAS Number | 780792-83-8 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)F)C#N)C3=CC=CO3)C(=O)OCC=C |
Product Overview
VU0507415-1 (CAS 780792-83-8), with molecular formula C23H20FN3O4S and molecular weight 453.12 g/mol. IUPAC: prop-2-enyl 5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of VU0507415-1
Property Insights of VU0507415-1
The XLogP value of 4.21578 indicates that VU0507415-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.36 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0507415-1. Following Lipinski's Rule of Five, VU0507415-1 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of VU0507415-1?
The CAS number of VU0507415-1 is 780792-83-8.
What is the molecular formula of VU0507415-1?
The molecular formula of VU0507415-1 is C23H20FN3O4S.
What is the molecular weight of VU0507415-1?
The molecular weight of VU0507415-1 is 453.12 g/mol.
Where can I buy VU0507415-1?
You can request a quote for VU0507415-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0507415-1?
Yes, KEHONG BIO provides custom synthesis services for VU0507415-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.