BIM-0019808.P001
TL;DR: BIM-0019808.P001 (CAS 5380-59-6) is a chemical compound with molecular formula C14H8BrF3N2O3 and molecular weight 387.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one
Also Known As: BIM-0019808.P001, 6-[2-(6-bromo-1,3-benzodioxol-5-yl)vinyl]-4-(trifluoromethyl)-2(1H)-pyrimidinone, A2338/0098687, 4-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one, 4-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]-6-(trifluoromethyl)pyrimidin-2(1H)-one
| Molecular Formula | C14H8BrF3N2O3 |
|---|---|
| Molecular Weight | 387.97 g/mol |
| LogP | 3.4503 |
| Topological Polar Surface Area | 64.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 387.96704 |
| Heavy Atoms | 23 |
| Complexity | 846.1367 |
Chemical Identifiers
| CAS Number | 5380-59-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)/C=C/C3=NC(=O)NC(=C3)C(F)(F)F)Br |
Product Overview
BIM-0019808.P001 (CAS 5380-59-6), with molecular formula C14H8BrF3N2O3 and molecular weight 387.97 g/mol. IUPAC: 4-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one.
Chemical Property Profile of BIM-0019808.P001
Property Insights of BIM-0019808.P001
The XLogP value of 3.4503 indicates that BIM-0019808.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0019808.P001. Following Lipinski's Rule of Five, BIM-0019808.P001 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 BIM-0019808.P001?
The CAS number of BIM-0019808.P001 is 5380-59-6.
What is the molecular formula of BIM-0019808.P001?
The molecular formula of BIM-0019808.P001 is C14H8BrF3N2O3.
What is the molecular weight of BIM-0019808.P001?
The molecular weight of BIM-0019808.P001 is 387.97 g/mol.
Where can I buy BIM-0019808.P001?
You can request a quote for BIM-0019808.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0019808.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0019808.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.