AF-399/41115258
TL;DR: AF-399/41115258 (CAS 384374-57-6) is a chemical compound with molecular formula C27H29N3O3 and molecular weight 443.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione
Also Known As: AF-399/41115258, 1-(3-(1H-imidazol-1-yl)propyl)-3-hydroxy-5-(4-isopropylphenyl)-4-(4-methylbenzoyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione, 3-hydroxy-1-(3-imidazolylpropyl)-5-[4-(methylethyl)phenyl]-4-[(4-methylphenyl) carbonyl]-3-pyrrolin-2-one, 3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(4-methylphenyl)carbonyl]-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C27H29N3O3 |
|---|---|
| Molecular Weight | 443.22 g/mol |
| LogP | 4.82692 |
| Topological Polar Surface Area | 75.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.2209 |
| Heavy Atoms | 33 |
| Complexity | 1160.3353 |
Chemical Identifiers
| CAS Number | 384374-57-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=C(C=C4)C(C)C)/O |
Product Overview
AF-399/41115258 (CAS 384374-57-6), with molecular formula C27H29N3O3 and molecular weight 443.22 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AF-399/41115258
Property Insights of AF-399/41115258
The XLogP value of 4.82692 indicates that AF-399/41115258 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/41115258. Following Lipinski's Rule of Five, AF-399/41115258 has 1 hydrogen bond donor(s) and 4 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-399/41115258?
The CAS number of AF-399/41115258 is 384374-57-6.
What is the molecular formula of AF-399/41115258?
The molecular formula of AF-399/41115258 is C27H29N3O3.
What is the molecular weight of AF-399/41115258?
The molecular weight of AF-399/41115258 is 443.22 g/mol.
Where can I buy AF-399/41115258?
You can request a quote for AF-399/41115258 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41115258?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41115258 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.