AN-698/40781691
TL;DR: AN-698/40781691 (CAS 496767-79-4) is a chemical compound with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(2-methoxyethyl)-2-phenylimino-5-[(2-propan-2-yloxyphenyl)methylidene]-1,3-thiazolidin-4-one
Also Known As: AN-698/40781691, (2Z,5Z)-5-(2-isopropoxybenzylidene)-3-(2-methoxyethyl)-2-(phenylimino)thiazolidin-4-one, (2Z,5Z)-3-(2-methoxyethyl)-2-(phenylimino)-5-[2-(propan-2-yloxy)benzylidene]-1,3-thiazolidin-4-one, (5Z)-3-(2-methoxyethyl)-2-phenylimino-5-[(2-propan-2-yloxyphenyl)methylidene]-1,3-thiazolidin-4-one, 5-(2-isopropoxybenzylidene)-3-(2-methoxyethyl)-2-(phenylimino)-1,3-thiazolidin-4-one
| Molecular Formula | C22H24N2O3S |
|---|---|
| Molecular Weight | 396.15 g/mol |
| LogP | 4.7242 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.15076 |
| Heavy Atoms | 28 |
| Complexity | 878.3604 |
Chemical Identifiers
| CAS Number | 496767-79-4 |
|---|---|
| SMILES | CC(C)OC1=CC=CC=C1/C=C\2/C(=O)N(C(=NC3=CC=CC=C3)S2)CCOC |
Product Overview
AN-698/40781691 (CAS 496767-79-4), with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol. IUPAC: (5Z)-3-(2-methoxyethyl)-2-phenylimino-5-[(2-propan-2-yloxyphenyl)methylidene]-1,3-thiazolidin-4-one.
Chemical Property Profile of AN-698/40781691
Property Insights of AN-698/40781691
The XLogP value of 4.7242 indicates that AN-698/40781691 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, AN-698/40781691 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-698/40781691 has 0 hydrogen bond donor(s) and 5 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 AN-698/40781691?
The CAS number of AN-698/40781691 is 496767-79-4.
What is the molecular formula of AN-698/40781691?
The molecular formula of AN-698/40781691 is C22H24N2O3S.
What is the molecular weight of AN-698/40781691?
The molecular weight of AN-698/40781691 is 396.15 g/mol.
Where can I buy AN-698/40781691?
You can request a quote for AN-698/40781691 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-698/40781691?
Yes, KEHONG BIO provides custom synthesis services for AN-698/40781691 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.