AM-879/40861474
TL;DR: AM-879/40861474 (CAS 445407-13-6) is a chemical compound with molecular formula C22H16FN3O3S and molecular weight 421.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-1-(4-fluorophenyl)-5-[[1-(4-methoxyphenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AM-879/40861474, (5Z)-1-(4-fluorophenyl)-5-{[1-(4-methoxyphenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (Z)-1-(4-fluorophenyl)-5-((1-(4-methoxyphenyl)-1H-pyrrol-2-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5Z)-1-(4-fluorophenyl)-5-[[1-(4-methoxyphenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-1-(4-fluorophenyl)-5-{[1-(4-methoxyphenyl)-1H-pyrrol-2-yl]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C22H16FN3O3S |
|---|---|
| Molecular Weight | 421.09 g/mol |
| LogP | 3.4563 |
| Topological Polar Surface Area | 63.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.08963 |
| Heavy Atoms | 30 |
| Complexity | 1167.0983 |
Chemical Identifiers
| CAS Number | 445407-13-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C=CC=C2/C=C\3/C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F |
Product Overview
AM-879/40861474 (CAS 445407-13-6), with molecular formula C22H16FN3O3S and molecular weight 421.09 g/mol. IUPAC: (5Z)-1-(4-fluorophenyl)-5-[[1-(4-methoxyphenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AM-879/40861474
Property Insights of AM-879/40861474
The XLogP value of 3.4563 indicates that AM-879/40861474 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.57 Ų falls within the moderate polarity range, balancing permeability and solubility for AM-879/40861474. Following Lipinski's Rule of Five, AM-879/40861474 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 AM-879/40861474?
The CAS number of AM-879/40861474 is 445407-13-6.
What is the molecular formula of AM-879/40861474?
The molecular formula of AM-879/40861474 is C22H16FN3O3S.
What is the molecular weight of AM-879/40861474?
The molecular weight of AM-879/40861474 is 421.09 g/mol.
Where can I buy AM-879/40861474?
You can request a quote for AM-879/40861474 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AM-879/40861474?
Yes, KEHONG BIO provides custom synthesis services for AM-879/40861474 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.