F0605-0472
TL;DR: F0605-0472 (CAS 851093-61-3) is a chemical compound with molecular formula C21H14BrN3O7S and molecular weight 530.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-methyl-4-(4-nitrophenyl)sulfonyl-1-phenylpyrazol-5-yl] 5-bromofuran-2-carboxylate
Also Known As: F0605-0472, 3-methyl-4-((4-nitrophenyl)sulfonyl)-1-phenyl-1H-pyrazol-5-yl 5-bromofuran-2-carboxylate, [5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenylpyrazol-3-yl] 5-bromofuran-2-carboxylate, [5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenyl-pyrazol-3-yl] 5-bromofuran-2-carboxylate, 3-METHYL-4-(4-NITROBENZENESULFONYL)-1-PHENYL-1H-PYRAZOL-5-YL 5-BROMOFURAN-2-CARBOXYLATE
| Molecular Formula | C21H14BrN3O7S |
|---|---|
| Molecular Weight | 530.97 g/mol |
| LogP | 4.49642 |
| Topological Polar Surface Area | 134.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 530.9736 |
| Heavy Atoms | 33 |
| Complexity | 1459.5186 |
Chemical Identifiers
| CAS Number | 851093-61-3 |
|---|---|
| SMILES | CC1=NN(C(=C1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(O3)Br)C4=CC=CC=C4 |
Product Overview
F0605-0472 (CAS 851093-61-3), with molecular formula C21H14BrN3O7S and molecular weight 530.97 g/mol. IUPAC: [3-methyl-4-(4-nitrophenyl)sulfonyl-1-phenylpyrazol-5-yl] 5-bromofuran-2-carboxylate.
Chemical Property Profile of F0605-0472
Property Insights of F0605-0472
The XLogP value of 4.49642 indicates that F0605-0472 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.54 Ų falls within the moderate polarity range, balancing permeability and solubility for F0605-0472. Following Lipinski's Rule of Five, F0605-0472 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0605-0472?
The CAS number of F0605-0472 is 851093-61-3.
What is the molecular formula of F0605-0472?
The molecular formula of F0605-0472 is C21H14BrN3O7S.
What is the molecular weight of F0605-0472?
The molecular weight of F0605-0472 is 530.97 g/mol.
Where can I buy F0605-0472?
You can request a quote for F0605-0472 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0605-0472?
Yes, KEHONG BIO provides custom synthesis services for F0605-0472 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.