ChemDiv1_000067
TL;DR: ChemDiv1_000067 (CAS 304446-44-4) is a chemical compound with molecular formula C30H27BrN4O3 and molecular weight 570.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-[2-(2-morpholin-4-ylacetyl)-3-phenyl-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one
Also Known As: ChemDiv1_000067, BAS 00163827, 6-bromo-3-(1-(2-morpholinoacetyl)-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-phenylquinolin-2(1H)-one, AB00667560-01, F0342-0032
| Molecular Formula | C30H27BrN4O3 |
|---|---|
| Molecular Weight | 570.13 g/mol |
| LogP | 4.9675 |
| Topological Polar Surface Area | 78.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 570.12665 |
| Heavy Atoms | 38 |
| Complexity | 1563.4907 |
Chemical Identifiers
| CAS Number | 304446-44-4 |
|---|---|
| SMILES | C1COCCN1CC(=O)N2C(CC(=N2)C3=C(C4=C(C=CC(=C4)Br)NC3=O)C5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
ChemDiv1_000067 (CAS 304446-44-4), with molecular formula C30H27BrN4O3 and molecular weight 570.13 g/mol. IUPAC: 6-bromo-3-[2-(2-morpholin-4-ylacetyl)-3-phenyl-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of ChemDiv1_000067
Property Insights of ChemDiv1_000067
The XLogP value of 4.9675 indicates that ChemDiv1_000067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_000067. Following Lipinski's Rule of Five, ChemDiv1_000067 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_000067?
The CAS number of ChemDiv1_000067 is 304446-44-4.
What is the molecular formula of ChemDiv1_000067?
The molecular formula of ChemDiv1_000067 is C30H27BrN4O3.
What is the molecular weight of ChemDiv1_000067?
The molecular weight of ChemDiv1_000067 is 570.13 g/mol.
Where can I buy ChemDiv1_000067?
You can request a quote for ChemDiv1_000067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_000067?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_000067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.