AF-399/42100495
TL;DR: AF-399/42100495 (CAS 371924-39-9) is a chemical compound with molecular formula C26H30N2O6 and molecular weight 466.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-hydroxyphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
Also Known As: AF-399/42100495, 3-hydroxy-5-(4-hydroxyphenyl)-4-(4-isopropoxybenzoyl)-1-[2-(4-morpholinyl)ethyl]-1,5-dihydro-2H-pyrrol-2-one, (4E)-5-(4-hydroxyphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione, (4E)-5-(4-hydroxyphenyl)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione, 3-hydroxy-5-(4-hydroxyphenyl)-1-[2-(morpholin-4-yl)ethyl]-4-{[4-(propan-2-yloxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C26H30N2O6 |
|---|---|
| Molecular Weight | 466.21 g/mol |
| LogP | 2.9333 |
| Topological Polar Surface Area | 99.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.2104 |
| Heavy Atoms | 34 |
| Complexity | 1055.7034 |
Chemical Identifiers
| CAS Number | 371924-39-9 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)O)/O |
Product Overview
AF-399/42100495 (CAS 371924-39-9), with molecular formula C26H30N2O6 and molecular weight 466.21 g/mol. IUPAC: (4E)-5-(4-hydroxyphenyl)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/42100495
Property Insights of AF-399/42100495
The XLogP value of 2.9333 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/42100495. The TPSA of 99.54 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42100495. Following Lipinski's Rule of Five, AF-399/42100495 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 AF-399/42100495?
The CAS number of AF-399/42100495 is 371924-39-9.
What is the molecular formula of AF-399/42100495?
The molecular formula of AF-399/42100495 is C26H30N2O6.
What is the molecular weight of AF-399/42100495?
The molecular weight of AF-399/42100495 is 466.21 g/mol.
Where can I buy AF-399/42100495?
You can request a quote for AF-399/42100495 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42100495?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42100495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.