ChemDiv1_007247
TL;DR: ChemDiv1_007247 (CAS 361198-69-8) is a chemical compound with molecular formula C19H19BrN2O3 and molecular weight 402.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(4-bromophenyl)-3-(2,5-dimethoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone
Also Known As: ChemDiv1_007247, F0477-0104, 1-(3-(4-bromophenyl)-5-(2,5-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone, 1-[3-(4-bromophenyl)-5-(2,5-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one, A2671/0113765
| Molecular Formula | C19H19BrN2O3 |
|---|---|
| Molecular Weight | 402.06 g/mol |
| LogP | 4.1639 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.05792 |
| Heavy Atoms | 25 |
| Complexity | 817.91895 |
Chemical Identifiers
| CAS Number | 361198-69-8 |
|---|---|
| SMILES | CC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=C(C=CC(=C3)OC)OC |
Product Overview
ChemDiv1_007247 (CAS 361198-69-8), with molecular formula C19H19BrN2O3 and molecular weight 402.06 g/mol. IUPAC: 1-[5-(4-bromophenyl)-3-(2,5-dimethoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone.
Chemical Property Profile of ChemDiv1_007247
Property Insights of ChemDiv1_007247
The XLogP value of 4.1639 indicates that ChemDiv1_007247 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.13 Ų, ChemDiv1_007247 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_007247 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 ChemDiv1_007247?
The CAS number of ChemDiv1_007247 is 361198-69-8.
What is the molecular formula of ChemDiv1_007247?
The molecular formula of ChemDiv1_007247 is C19H19BrN2O3.
What is the molecular weight of ChemDiv1_007247?
The molecular weight of ChemDiv1_007247 is 402.06 g/mol.
Where can I buy ChemDiv1_007247?
You can request a quote for ChemDiv1_007247 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007247?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007247 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.