ChemDiv1_000249
TL;DR: ChemDiv1_000249 (CAS 320368-06-7) is a chemical compound with molecular formula C29H22ClN5O3 and molecular weight 523.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-acetyl-3-(1-acetylbenzimidazol-2-yl)-3,4-dihydropyrazol-5-yl]-6-chloro-4-phenyl-1H-quinolin-2-one
Also Known As: ChemDiv1_000249, AB00666685-01, F0011-0778, 3-(1-acetyl-5-(1-acetyl-1H-benzo[d]imidazol-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)-6-chloro-4-phenylquinolin-2(1H)-one, 3-[1-acetyl-5-(1-acetyl-1H-1,3-benzodiazol-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-6-chloro-4-phenyl-1,2-dihydroquinolin-2-one
| Molecular Formula | C29H22ClN5O3 |
|---|---|
| Molecular Weight | 523.14 g/mol |
| LogP | 5.5559 |
| Topological Polar Surface Area | 100.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 523.1411 |
| Heavy Atoms | 38 |
| Complexity | 1855.5355 |
Chemical Identifiers
| CAS Number | 320368-06-7 |
|---|---|
| SMILES | CC(=O)N1C(CC(=N1)C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C5=NC6=CC=CC=C6N5C(=O)C |
Product Overview
ChemDiv1_000249 (CAS 320368-06-7), with molecular formula C29H22ClN5O3 and molecular weight 523.14 g/mol. IUPAC: 3-[2-acetyl-3-(1-acetylbenzimidazol-2-yl)-3,4-dihydropyrazol-5-yl]-6-chloro-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of ChemDiv1_000249
Property Insights of ChemDiv1_000249
The XLogP value of 5.5559 indicates that ChemDiv1_000249 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.42 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_000249. Following Lipinski's Rule of Five, ChemDiv1_000249 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_000249?
The CAS number of ChemDiv1_000249 is 320368-06-7.
What is the molecular formula of ChemDiv1_000249?
The molecular formula of ChemDiv1_000249 is C29H22ClN5O3.
What is the molecular weight of ChemDiv1_000249?
The molecular weight of ChemDiv1_000249 is 523.14 g/mol.
Where can I buy ChemDiv1_000249?
You can request a quote for ChemDiv1_000249 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_000249?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_000249 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.