BIM-0048480.P001
TL;DR: BIM-0048480.P001 (CAS 5838-93-7) is a chemical compound with molecular formula C21H14FN3O3S and molecular weight 407.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-one
Also Known As: BIM-0048480.P001, (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-one, (4Z)-4-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C21H14FN3O3S |
|---|---|
| Molecular Weight | 407.07 g/mol |
| LogP | 4.484 |
| Topological Polar Surface Area | 64.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.074 |
| Heavy Atoms | 29 |
| Complexity | 1184.137 |
Chemical Identifiers
| CAS Number | 5838-93-7 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C\C2=CC3=C(C=C2)OCO3)C4=NC(=CS4)C5=CC=C(C=C5)F |
Product Overview
BIM-0048480.P001 (CAS 5838-93-7), with molecular formula C21H14FN3O3S and molecular weight 407.07 g/mol. IUPAC: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-one.
Chemical Property Profile of BIM-0048480.P001
Property Insights of BIM-0048480.P001
The XLogP value of 4.484 indicates that BIM-0048480.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0048480.P001. Following Lipinski's Rule of Five, BIM-0048480.P001 has 0 hydrogen bond donor(s) and 6 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-0048480.P001?
The CAS number of BIM-0048480.P001 is 5838-93-7.
What is the molecular formula of BIM-0048480.P001?
The molecular formula of BIM-0048480.P001 is C21H14FN3O3S.
What is the molecular weight of BIM-0048480.P001?
The molecular weight of BIM-0048480.P001 is 407.07 g/mol.
Where can I buy BIM-0048480.P001?
You can request a quote for BIM-0048480.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0048480.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0048480.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.