AH-487/11927113
TL;DR: AH-487/11927113 (CAS 340213-74-3) is a chemical compound with molecular formula C18H12BrClN2O3S and molecular weight 449.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-1-(4-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AH-487/11927113, (5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-1-(4-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-(3-bromo-4-methoxybenzylidene)-1-(4-chlorophenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
| Molecular Formula | C18H12BrClN2O3S |
|---|---|
| Molecular Weight | 449.94 g/mol |
| LogP | 3.9424 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 449.94406 |
| Heavy Atoms | 26 |
| Complexity | 943.95245 |
Chemical Identifiers
| CAS Number | 340213-74-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C/2\C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl)Br |
Product Overview
AH-487/11927113 (CAS 340213-74-3), with molecular formula C18H12BrClN2O3S and molecular weight 449.94 g/mol. IUPAC: (5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-1-(4-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AH-487/11927113
Property Insights of AH-487/11927113
The XLogP value of 3.9424 indicates that AH-487/11927113 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AH-487/11927113 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AH-487/11927113 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 AH-487/11927113?
The CAS number of AH-487/11927113 is 340213-74-3.
What is the molecular formula of AH-487/11927113?
The molecular formula of AH-487/11927113 is C18H12BrClN2O3S.
What is the molecular weight of AH-487/11927113?
The molecular weight of AH-487/11927113 is 449.94 g/mol.
Where can I buy AH-487/11927113?
You can request a quote for AH-487/11927113 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/11927113?
Yes, KEHONG BIO provides custom synthesis services for AH-487/11927113 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.