(4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone
TL;DR: (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone (CAS 312502-98-0) is a chemical compound with molecular formula C10H4BrClF2N2O and molecular weight 319.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromopyrazol-1-yl)-(2-chloro-4,5-difluorophenyl)methanone
Also Known As: N-Benzoylpyrazole deriv., 27, BAS 02052936, 4-bromopyrazolyl 2-chloro-4,5-difluorophenyl ketone, (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone, (4-bromopyrazol-1-yl)-(2-chloro-4,5-difluorophenyl)methanone
| Molecular Formula | C10H4BrClF2N2O |
|---|---|
| Molecular Weight | 319.92 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 319.91635 |
| Heavy Atoms | 17 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 312502-98-0 |
|---|---|
| SMILES | C1=C(C(=CC(=C1F)F)Cl)C(=O)N2C=C(C=N2)Br |
| InChIKey | SSRIKTAQJWMPPG-UHFFFAOYSA-N |
Product Overview
(4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone (CAS 312502-98-0), with molecular formula C10H4BrClF2N2O and molecular weight 319.92 g/mol. IUPAC: (4-bromopyrazol-1-yl)-(2-chloro-4,5-difluorophenyl)methanone.
Chemical Property Profile of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone
Property Insights of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone
The XLogP value of 3.3 indicates that (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.9 Ų, (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone has 0 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 (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone?
The CAS number of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone is 312502-98-0.
What is the molecular formula of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone?
The molecular formula of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone is C10H4BrClF2N2O.
What is the molecular weight of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone?
The molecular weight of (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone is 319.92 g/mol.
Where can I buy (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone?
You can request a quote for (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-bromo-1H-pyrazol-1-yl)(2-chloro-4,5-difluorophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.