BAS 00163853
TL;DR: BAS 00163853 (CAS 299419-05-9) is a chemical compound with molecular formula C27H22BrNO3 and molecular weight 487.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Also Known As: BAS 00163853, BIM-0034402.P001, (E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one, (2E)-1-(6-BROMO-2-METHYL-4-PHENYLQUINOLIN-3-YL)-3-(3,4-DIMETHOXYPHENYL)PROP-2-EN-1-ONE, (2E)-3-(3,4-dimethoxyphenyl)-1-(6-bromo-2-methyl-4-phenyl(3-quinolyl))prop-2-e n-1-one
| Molecular Formula | C27H22BrNO3 |
|---|---|
| Molecular Weight | 487.08 g/mol |
| LogP | 6.88602 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 487.0783 |
| Heavy Atoms | 32 |
| Complexity | 1330.0656 |
Chemical Identifiers
| CAS Number | 299419-05-9 |
|---|---|
| SMILES | CC1=C(C(=C2C=C(C=CC2=N1)Br)C3=CC=CC=C3)C(=O)/C=C/C4=CC(=C(C=C4)OC)OC |
Product Overview
BAS 00163853 (CAS 299419-05-9), with molecular formula C27H22BrNO3 and molecular weight 487.08 g/mol. IUPAC: (E)-1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of BAS 00163853
Property Insights of BAS 00163853
The XLogP value of 6.88602 indicates that BAS 00163853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, BAS 00163853 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00163853 has 0 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 00163853?
The CAS number of BAS 00163853 is 299419-05-9.
What is the molecular formula of BAS 00163853?
The molecular formula of BAS 00163853 is C27H22BrNO3.
What is the molecular weight of BAS 00163853?
The molecular weight of BAS 00163853 is 487.08 g/mol.
Where can I buy BAS 00163853?
You can request a quote for BAS 00163853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00163853?
Yes, KEHONG BIO provides custom synthesis services for BAS 00163853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.