BIM-0042962.P001
TL;DR: BIM-0042962.P001 (CAS 340303-11-9) is a chemical compound with molecular formula C21H13FN2O3S2 and molecular weight 424.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(2-fluorophenyl)-5-[(5-phenylsulfanylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BIM-0042962.P001, (5E)-1-(2-fluorophenyl)-5-[(5-phenylsulfanylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, (5E)-1-(2-fluorophenyl)-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C21H13FN2O3S2 |
|---|---|
| Molecular Weight | 424.04 g/mol |
| LogP | 4.4012 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.03516 |
| Heavy Atoms | 29 |
| Complexity | 1141.5927 |
Chemical Identifiers
| CAS Number | 340303-11-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CC=C(O2)/C=C/3\C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F |
Product Overview
BIM-0042962.P001 (CAS 340303-11-9), with molecular formula C21H13FN2O3S2 and molecular weight 424.04 g/mol. IUPAC: (5E)-1-(2-fluorophenyl)-5-[(5-phenylsulfanylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BIM-0042962.P001
Property Insights of BIM-0042962.P001
The XLogP value of 4.4012 indicates that BIM-0042962.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0042962.P001. Following Lipinski's Rule of Five, BIM-0042962.P001 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 BIM-0042962.P001?
The CAS number of BIM-0042962.P001 is 340303-11-9.
What is the molecular formula of BIM-0042962.P001?
The molecular formula of BIM-0042962.P001 is C21H13FN2O3S2.
What is the molecular weight of BIM-0042962.P001?
The molecular weight of BIM-0042962.P001 is 424.04 g/mol.
Where can I buy BIM-0042962.P001?
You can request a quote for BIM-0042962.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042962.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042962.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.