BAS 01045111
TL;DR: BAS 01045111 (CAS 353239-79-9) is a chemical compound with molecular formula C25H24ClNO2 and molecular weight 405.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3H-quinolin-1-yl]-3-(furan-2-yl)prop-2-en-1-one
Also Known As: BAS 01045111, 4-(4-chlorophenyl)-1-[3-(2-furyl)acryloyl]-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline, (2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl(1,2,3,4-tetrahydroquinolyl)]-3-(2-f uryl)prop-2-en-1-one, (2E)-1-[4-(4-CHLOROPHENYL)-2,2,4-TRIMETHYL-1,2,3,4-TETRAHYDROQUINOLIN-1-YL]-3-(FURAN-2-YL)PROP-2-EN-1-ONE, (2E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl]-3-(furan-2-yl)prop-2-en-1-one
| Molecular Formula | C25H24ClNO2 |
|---|---|
| Molecular Weight | 405.15 g/mol |
| LogP | 6.4677 |
| Topological Polar Surface Area | 33.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.14957 |
| Heavy Atoms | 29 |
| Complexity | 1050.6921 |
Chemical Identifiers
| CAS Number | 353239-79-9 |
|---|---|
| SMILES | CC1(CC(C2=CC=CC=C2N1C(=O)/C=C/C3=CC=CO3)(C)C4=CC=C(C=C4)Cl)C |
Product Overview
BAS 01045111 (CAS 353239-79-9), with molecular formula C25H24ClNO2 and molecular weight 405.15 g/mol. IUPAC: (E)-1-[4-(4-chlorophenyl)-2,2,4-trimethyl-3H-quinolin-1-yl]-3-(furan-2-yl)prop-2-en-1-one.
Chemical Property Profile of BAS 01045111
Property Insights of BAS 01045111
The XLogP value of 6.4677 indicates that BAS 01045111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.45 Ų, BAS 01045111 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01045111 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01045111?
The CAS number of BAS 01045111 is 353239-79-9.
What is the molecular formula of BAS 01045111?
The molecular formula of BAS 01045111 is C25H24ClNO2.
What is the molecular weight of BAS 01045111?
The molecular weight of BAS 01045111 is 405.15 g/mol.
Where can I buy BAS 01045111?
You can request a quote for BAS 01045111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01045111?
Yes, KEHONG BIO provides custom synthesis services for BAS 01045111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.