AM-879/40861227
TL;DR: AM-879/40861227 (CAS 445406-96-2) is a chemical compound with molecular formula C27H17FN4O2S and molecular weight 480.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-[(Z)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]methyl]benzonitrile
Also Known As: AM-879/40861227, (Z)-2-((3-((1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1H-indol-1-yl)methyl)benzonitrile, 2-({3-[(1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}methyl)benzonitrile, 2-[(3-{(Z)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-1-yl)methyl]benzonitrile, 2-[[3-[(Z)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]methyl]benzonitrile
| Molecular Formula | C27H17FN4O2S |
|---|---|
| Molecular Weight | 480.11 g/mol |
| LogP | 4.53168 |
| Topological Polar Surface Area | 78.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 480.10562 |
| Heavy Atoms | 35 |
| Complexity | 1581.0267 |
Chemical Identifiers
| CAS Number | 445406-96-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)/C=C\4/C(=O)NC(=S)N(C4=O)C5=CC=C(C=C5)F)C#N |
Product Overview
AM-879/40861227 (CAS 445406-96-2), with molecular formula C27H17FN4O2S and molecular weight 480.11 g/mol. IUPAC: 2-[[3-[(Z)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]methyl]benzonitrile.
Chemical Property Profile of AM-879/40861227
Property Insights of AM-879/40861227
The XLogP value of 4.53168 indicates that AM-879/40861227 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AM-879/40861227. Following Lipinski's Rule of Five, AM-879/40861227 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-879/40861227?
The CAS number of AM-879/40861227 is 445406-96-2.
What is the molecular formula of AM-879/40861227?
The molecular formula of AM-879/40861227 is C27H17FN4O2S.
What is the molecular weight of AM-879/40861227?
The molecular weight of AM-879/40861227 is 480.11 g/mol.
Where can I buy AM-879/40861227?
You can request a quote for AM-879/40861227 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AM-879/40861227?
Yes, KEHONG BIO provides custom synthesis services for AM-879/40861227 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.