AN-989/40822724
TL;DR: AN-989/40822724 (CAS 431925-99-4) is a chemical compound with molecular formula C18H18N2O6S and molecular weight 390.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(Z)-[3-(2-morpholin-4-yl-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]benzoate
Also Known As: AN-989/40822724, methyl 4-({3-[2-(4-morpholinyl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoate, methyl 4-[(Z)-[3-(2-morpholin-4-yl-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]benzoate, (Z)-methyl 4-((3-(2-morpholino-2-oxoethyl)-2,4-dioxothiazolidin-5-ylidene)methyl)benzoate, methyl 4-[(Z)-{3-[2-(morpholin-4-yl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]benzoate
| Molecular Formula | C18H18N2O6S |
|---|---|
| Molecular Weight | 390.09 g/mol |
| LogP | 1.3683 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.08856 |
| Heavy Atoms | 27 |
| Complexity | 798.5748 |
Chemical Identifiers
| CAS Number | 431925-99-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=O)S2)CC(=O)N3CCOCC3 |
Product Overview
AN-989/40822724 (CAS 431925-99-4), with molecular formula C18H18N2O6S and molecular weight 390.09 g/mol. IUPAC: methyl 4-[(Z)-[3-(2-morpholin-4-yl-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]benzoate.
Chemical Property Profile of AN-989/40822724
Property Insights of AN-989/40822724
The XLogP value of 1.3683 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-989/40822724. The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-989/40822724. Following Lipinski's Rule of Five, AN-989/40822724 has 0 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 AN-989/40822724?
The CAS number of AN-989/40822724 is 431925-99-4.
What is the molecular formula of AN-989/40822724?
The molecular formula of AN-989/40822724 is C18H18N2O6S.
What is the molecular weight of AN-989/40822724?
The molecular weight of AN-989/40822724 is 390.09 g/mol.
Where can I buy AN-989/40822724?
You can request a quote for AN-989/40822724 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-989/40822724?
Yes, KEHONG BIO provides custom synthesis services for AN-989/40822724 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.