BAS 00899623
TL;DR: BAS 00899623 (CAS 330189-41-8) is a chemical compound with molecular formula C30H26BrN3O3 and molecular weight 555.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-bromophenyl)-5-(2,6-dimethyl-4-phenylquinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
Also Known As: BAS 00899623, F0324-0045, 4-(5-(4-bromophenyl)-3-(2,6-dimethyl-4-phenylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl)-4-oxobutanoic acid, 4-[5-(4-bromophenyl)-3-(2,6-dimethyl-4-phenylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid, 4-[3-(4-bromophenyl)-5-(2,6-dimethyl-4-phenylquinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
| Molecular Formula | C30H26BrN3O3 |
|---|---|
| Molecular Weight | 555.12 g/mol |
| LogP | 6.82364 |
| Topological Polar Surface Area | 82.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 555.1157 |
| Heavy Atoms | 37 |
| Complexity | 1531.757 |
Chemical Identifiers
| CAS Number | 330189-41-8 |
|---|---|
| SMILES | CC1=CC2=C(C(=C(N=C2C=C1)C)C3=NN(C(C3)C4=CC=C(C=C4)Br)C(=O)CCC(=O)O)C5=CC=CC=C5 |
Product Overview
BAS 00899623 (CAS 330189-41-8), with molecular formula C30H26BrN3O3 and molecular weight 555.12 g/mol. IUPAC: 4-[3-(4-bromophenyl)-5-(2,6-dimethyl-4-phenylquinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid.
Chemical Property Profile of BAS 00899623
Property Insights of BAS 00899623
The XLogP value of 6.82364 indicates that BAS 00899623 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00899623. Following Lipinski's Rule of Five, BAS 00899623 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 BAS 00899623?
The CAS number of BAS 00899623 is 330189-41-8.
What is the molecular formula of BAS 00899623?
The molecular formula of BAS 00899623 is C30H26BrN3O3.
What is the molecular weight of BAS 00899623?
The molecular weight of BAS 00899623 is 555.12 g/mol.
Where can I buy BAS 00899623?
You can request a quote for BAS 00899623 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00899623?
Yes, KEHONG BIO provides custom synthesis services for BAS 00899623 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.