AH-487/40935555
TL;DR: AH-487/40935555 (CAS 444178-95-4) is a chemical compound with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-(diethylamino)furan-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AH-487/40935555, BRD-K81074852-001-04-3, (5E)-5-{[5-(diethylamino)furan-2-yl]methylidene}-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5E)-5-[[5-(diethylamino)furan-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[1-(5-Diethylamino-furan-2-yl)-meth-(E)-ylidene]-1-methyl-2-thioxo-dihydro-pyrimidine-4,6-dione
| Molecular Formula | C14H17N3O3S |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 1.3823 |
| Topological Polar Surface Area | 65.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.09906 |
| Heavy Atoms | 21 |
| Complexity | 616.73535 |
Chemical Identifiers
| CAS Number | 444178-95-4 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(O1)/C=C/2\C(=O)NC(=S)N(C2=O)C |
Product Overview
AH-487/40935555 (CAS 444178-95-4), with molecular formula C14H17N3O3S and molecular weight 307.10 g/mol. IUPAC: (5E)-5-[[5-(diethylamino)furan-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of AH-487/40935555
Property Insights of AH-487/40935555
The XLogP value of 1.3823 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AH-487/40935555. The TPSA of 65.79 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/40935555. Following Lipinski's Rule of Five, AH-487/40935555 has 1 hydrogen bond donor(s) and 5 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-487/40935555?
The CAS number of AH-487/40935555 is 444178-95-4.
What is the molecular formula of AH-487/40935555?
The molecular formula of AH-487/40935555 is C14H17N3O3S.
What is the molecular weight of AH-487/40935555?
The molecular weight of AH-487/40935555 is 307.10 g/mol.
Where can I buy AH-487/40935555?
You can request a quote for AH-487/40935555 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/40935555?
Yes, KEHONG BIO provides custom synthesis services for AH-487/40935555 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.