![1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone structure](/static/products/1124/112475-97-5.webp)
1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone
TL;DR: 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone (CAS 112475-97-5) is a chemical compound with molecular formula C18H20BrN3O and molecular weight 373.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(4-bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone
Also Known As: AI-346/31791006, 1-[5-(4-bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone, 1-{5-[(4-bromophenyl)amino]-3-methyl-2-phenylpyrazolidin-1-yl}ethanone, N-(2-acetyl-5-methyl-1-phenyl-3-pyrazolidinyl)-N-(4-bromophenyl)amine
| Molecular Formula | C18H20BrN3O |
|---|---|
| Molecular Weight | 373.08 g/mol |
| LogP | 4.2494 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.07898 |
| Heavy Atoms | 23 |
| Complexity | 674.42584 |
Chemical Identifiers
| CAS Number | 112475-97-5 |
|---|---|
| SMILES | CC1CC(N(N1C2=CC=CC=C2)C(=O)C)NC3=CC=C(C=C3)Br |
Product Overview
1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone (CAS 112475-97-5), with molecular formula C18H20BrN3O and molecular weight 373.08 g/mol. IUPAC: 1-[5-(4-bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone.
Chemical Property Profile of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone
Property Insights of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone
The XLogP value of 4.2494 indicates that 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone 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 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone?
The CAS number of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone is 112475-97-5.
What is the molecular formula of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone?
The molecular formula of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone is C18H20BrN3O.
What is the molecular weight of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone?
The molecular weight of 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone is 373.08 g/mol.
Where can I buy 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone?
You can request a quote for 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[5-(4-Bromoanilino)-3-methyl-2-phenylpyrazolidin-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.