(3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone
TL;DR: (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone (CAS 64809-50-3) is a chemical compound with molecular formula C17H14BrN3O and molecular weight 355.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-anilino-5-methylpyrazol-1-yl)-(4-bromophenyl)methanone
Also Known As: (3-anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone, (3-anilino-5-methylpyrazol-1-yl)-(4-bromophenyl)methanone, 1H-Pyrazol-3-amine, 1-(4-bromobenzoyl)-5-methyl-N-phenyl-, 1-(4-bromobenzoyl)-5-methyl-N-phenyl-1H-pyrazol-3-amine, 2-Cyclohexen-1-one, 4-hydroxy-2,6,6-trimethyl-, (4S)-
| Molecular Formula | C17H14BrN3O |
|---|---|
| Molecular Weight | 355.03 g/mol |
| LogP | 4.38612 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.032 |
| Heavy Atoms | 22 |
| Complexity | 794.5312 |
Chemical Identifiers
| CAS Number | 64809-50-3 |
|---|---|
| SMILES | CC1=CC(=NN1C(=O)C2=CC=C(C=C2)Br)NC3=CC=CC=C3 |
Product Overview
(3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone (CAS 64809-50-3), with molecular formula C17H14BrN3O and molecular weight 355.03 g/mol. IUPAC: (3-anilino-5-methylpyrazol-1-yl)-(4-bromophenyl)methanone.
Chemical Property Profile of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone
Property Insights of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone
The XLogP value of 4.38612 indicates that (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone has 1 hydrogen bond donor(s) and 3 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 (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone?
The CAS number of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone is 64809-50-3.
What is the molecular formula of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone?
The molecular formula of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone is C17H14BrN3O.
What is the molecular weight of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone?
The molecular weight of (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone is 355.03 g/mol.
Where can I buy (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone?
You can request a quote for (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Anilino-5-methyl-1-pyrazolyl)-(4-bromophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.