12W-0855
TL;DR: 12W-0855 (CAS 860787-16-2) is a chemical compound with molecular formula C29H23F3N2O2 and molecular weight 488.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,11-dimethoxy-13-[[3-(trifluoromethyl)phenyl]methyl]-5,6-dihydroindolo[3,2-c]acridine
Also Known As: 12W-0855, 8,11-dimethoxy-13-[3-(trifluoromethyl)benzyl]-6,13-dihydro-5H-indolo[3,2-c]acridine, 8,11-dimethoxy-13-[[3-(trifluoromethyl)phenyl]methyl]-5,6-dihydroindolo[3,2-c]acridine, 16,19-dimethoxy-3-{[3-(trifluoromethyl)phenyl]methyl}-3,21-diazapentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{15,20}]henicosa-1(21),2(10),4(9),5,7,13,15(20),16,18-nonaene
| Molecular Formula | C29H23F3N2O2 |
|---|---|
| Molecular Weight | 488.17 g/mol |
| LogP | 7.0394 |
| Topological Polar Surface Area | 36.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.17117 |
| Heavy Atoms | 36 |
| Complexity | 1636.0192 |
Chemical Identifiers
| CAS Number | 860787-16-2 |
|---|---|
| SMILES | COC1=C2C=C3CCC4=C(C3=NC2=C(C=C1)OC)N(C5=CC=CC=C45)CC6=CC(=CC=C6)C(F)(F)F |
Product Overview
12W-0855 (CAS 860787-16-2), with molecular formula C29H23F3N2O2 and molecular weight 488.17 g/mol. IUPAC: 8,11-dimethoxy-13-[[3-(trifluoromethyl)phenyl]methyl]-5,6-dihydroindolo[3,2-c]acridine.
Chemical Property Profile of 12W-0855
Property Insights of 12W-0855
The XLogP value of 7.0394 indicates that 12W-0855 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.28 Ų, 12W-0855 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12W-0855 has 0 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 12W-0855?
The CAS number of 12W-0855 is 860787-16-2.
What is the molecular formula of 12W-0855?
The molecular formula of 12W-0855 is C29H23F3N2O2.
What is the molecular weight of 12W-0855?
The molecular weight of 12W-0855 is 488.17 g/mol.
Where can I buy 12W-0855?
You can request a quote for 12W-0855 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12W-0855?
Yes, KEHONG BIO provides custom synthesis services for 12W-0855 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.