ChemDiv1_002061
TL;DR: ChemDiv1_002061 (CAS 330662-87-8) is a chemical compound with molecular formula C24H19BrN4O2 and molecular weight 474.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1H-benzimidazol-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-(4-bromophenyl)methanone
Also Known As: ChemDiv1_002061, F0014-0888, 2-[1-(4-bromobenzoyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-1H-1,3-benzodiazole, (5-(1H-benzo[d]imidazol-2-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl)(4-bromophenyl)methanone, [3-(1H-benzimidazol-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-(4-bromophenyl)methanone
| Molecular Formula | C24H19BrN4O2 |
|---|---|
| Molecular Weight | 474.07 g/mol |
| LogP | 5.3255 |
| Topological Polar Surface Area | 70.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 474.06915 |
| Heavy Atoms | 31 |
| Complexity | 1246.1956 |
Chemical Identifiers
| CAS Number | 330662-87-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C(C2)C3=NC4=CC=CC=C4N3)C(=O)C5=CC=C(C=C5)Br |
Product Overview
ChemDiv1_002061 (CAS 330662-87-8), with molecular formula C24H19BrN4O2 and molecular weight 474.07 g/mol. IUPAC: [3-(1H-benzimidazol-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-(4-bromophenyl)methanone.
Chemical Property Profile of ChemDiv1_002061
Property Insights of ChemDiv1_002061
The XLogP value of 5.3255 indicates that ChemDiv1_002061 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.58 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002061. Following Lipinski's Rule of Five, ChemDiv1_002061 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_002061?
The CAS number of ChemDiv1_002061 is 330662-87-8.
What is the molecular formula of ChemDiv1_002061?
The molecular formula of ChemDiv1_002061 is C24H19BrN4O2.
What is the molecular weight of ChemDiv1_002061?
The molecular weight of ChemDiv1_002061 is 474.07 g/mol.
Where can I buy ChemDiv1_002061?
You can request a quote for ChemDiv1_002061 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002061?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002061 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.