BIM-0039486.P001
TL;DR: BIM-0039486.P001 (CAS 423753-31-5) is a chemical compound with molecular formula C18H13FN2O4S and molecular weight 372.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(4-fluorophenyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BIM-0039486.P001, (5E)-1-(4-fluorophenyl)-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5E)-1-(4-fluorophenyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C18H13FN2O4S |
|---|---|
| Molecular Weight | 372.06 g/mol |
| LogP | 2.3712 |
| Topological Polar Surface Area | 78.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.058 |
| Heavy Atoms | 26 |
| Complexity | 940.70734 |
Chemical Identifiers
| CAS Number | 423753-31-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/2\C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F)O |
Product Overview
BIM-0039486.P001 (CAS 423753-31-5), with molecular formula C18H13FN2O4S and molecular weight 372.06 g/mol. IUPAC: (5E)-1-(4-fluorophenyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BIM-0039486.P001
Property Insights of BIM-0039486.P001
The XLogP value of 2.3712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0039486.P001. The TPSA of 78.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0039486.P001. Following Lipinski's Rule of Five, BIM-0039486.P001 has 2 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 BIM-0039486.P001?
The CAS number of BIM-0039486.P001 is 423753-31-5.
What is the molecular formula of BIM-0039486.P001?
The molecular formula of BIM-0039486.P001 is C18H13FN2O4S.
What is the molecular weight of BIM-0039486.P001?
The molecular weight of BIM-0039486.P001 is 372.06 g/mol.
Where can I buy BIM-0039486.P001?
You can request a quote for BIM-0039486.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0039486.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0039486.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.