BAS 01052602
TL;DR: BAS 01052602 (CAS 313398-40-2) is a chemical compound with molecular formula C32H24ClN3O2 and molecular weight 517.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-phenyl-3-[3-phenyl-2-(2-phenylacetyl)-3,4-dihydropyrazol-5-yl]-1H-quinolin-2-one
Also Known As: BAS 01052602, (3E)-6-chloro-4-phenyl-3-[5-phenyl-1-(2-phenylacetyl)pyrazolidin-3-ylidene]quinolin-2-one, 6-chloro-4-phenyl-3-[5-phenyl-1-(2-phenylacetyl)pyrazolidin-3-ylidene]quinolin-2-one, 1-[3-(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethanone, 6-chloro-4-phenyl-3-(5-phenyl-1-(2-phenylacetyl)-4,5-dihydro-1H-pyrazol-3-yl)quinolin-2(1H)-one
| Molecular Formula | C32H24ClN3O2 |
|---|---|
| Molecular Weight | 517.16 g/mol |
| LogP | 6.7689 |
| Topological Polar Surface Area | 65.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 517.1557 |
| Heavy Atoms | 38 |
| Complexity | 1714.7307 |
Chemical Identifiers
| CAS Number | 313398-40-2 |
|---|---|
| SMILES | C1C(N(N=C1C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C(=O)CC5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
BAS 01052602 (CAS 313398-40-2), with molecular formula C32H24ClN3O2 and molecular weight 517.16 g/mol. IUPAC: 6-chloro-4-phenyl-3-[3-phenyl-2-(2-phenylacetyl)-3,4-dihydropyrazol-5-yl]-1H-quinolin-2-one.
Chemical Property Profile of BAS 01052602
Property Insights of BAS 01052602
The XLogP value of 6.7689 indicates that BAS 01052602 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01052602. Following Lipinski's Rule of Five, BAS 01052602 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01052602?
The CAS number of BAS 01052602 is 313398-40-2.
What is the molecular formula of BAS 01052602?
The molecular formula of BAS 01052602 is C32H24ClN3O2.
What is the molecular weight of BAS 01052602?
The molecular weight of BAS 01052602 is 517.16 g/mol.
Where can I buy BAS 01052602?
You can request a quote for BAS 01052602 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01052602?
Yes, KEHONG BIO provides custom synthesis services for BAS 01052602 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.