F0470-0111
TL;DR: F0470-0111 (CAS 391869-07-1) is a chemical compound with molecular formula C22H18ClN5O3S2 and molecular weight 499.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-5-methyl-N-[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide
Also Known As: F0470-0111, 3-(2-chlorophenyl)-5-methyl-N-(5-((2-oxo-2-(m-tolylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)isoxazole-4-carboxamide, 3-(2-chlorophenyl)-5-methyl-N-[5-({[(3-methylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide, 3-(2-chlorophenyl)-5-methyl-N-[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide
| Molecular Formula | C22H18ClN5O3S2 |
|---|---|
| Molecular Weight | 499.05 g/mol |
| LogP | 5.44644 |
| Topological Polar Surface Area | 110.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.05396 |
| Heavy Atoms | 33 |
| Complexity | 1320.871 |
Chemical Identifiers
| CAS Number | 391869-07-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=C(ON=C3C4=CC=CC=C4Cl)C |
Product Overview
F0470-0111 (CAS 391869-07-1), with molecular formula C22H18ClN5O3S2 and molecular weight 499.05 g/mol. IUPAC: 3-(2-chlorophenyl)-5-methyl-N-[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide.
Chemical Property Profile of F0470-0111
Property Insights of F0470-0111
The XLogP value of 5.44644 indicates that F0470-0111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.01 Ų falls within the moderate polarity range, balancing permeability and solubility for F0470-0111. Following Lipinski's Rule of Five, F0470-0111 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 F0470-0111?
The CAS number of F0470-0111 is 391869-07-1.
What is the molecular formula of F0470-0111?
The molecular formula of F0470-0111 is C22H18ClN5O3S2.
What is the molecular weight of F0470-0111?
The molecular weight of F0470-0111 is 499.05 g/mol.
Where can I buy F0470-0111?
You can request a quote for F0470-0111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0470-0111?
Yes, KEHONG BIO provides custom synthesis services for F0470-0111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.