8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one
TL;DR: 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one (CAS 859667-64-4) is a chemical compound with molecular formula C26H21ClN2O3 and molecular weight 444.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(2-chlorophenyl)-6,7-dimethoxy-10,20-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,14,16,18-heptaen-9-one
Also Known As: 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one
| Molecular Formula | C26H21ClN2O3 |
|---|---|
| Molecular Weight | 444.12 g/mol |
| LogP | 5.5292 |
| Topological Polar Surface Area | 54.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.12408 |
| Heavy Atoms | 32 |
| Complexity | 1393.3535 |
Chemical Identifiers
| CAS Number | 859667-64-4 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C3C4=C(C(CN3C2=O)C5=CC=CC=C5Cl)C6=CC=CC=C6N4)OC |
Product Overview
8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one (CAS 859667-64-4), with molecular formula C26H21ClN2O3 and molecular weight 444.12 g/mol. IUPAC: 12-(2-chlorophenyl)-6,7-dimethoxy-10,20-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),3(8),4,6,14,16,18-heptaen-9-one.
Chemical Property Profile of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one
Property Insights of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one
The XLogP value of 5.5292 indicates that 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.56 Ų, 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one 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 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one?
The CAS number of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one is 859667-64-4.
What is the molecular formula of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one?
The molecular formula of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one is C26H21ClN2O3.
What is the molecular weight of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one?
The molecular weight of 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one is 444.12 g/mol.
Where can I buy 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one?
You can request a quote for 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 8-(2-chlorophenyl)-3,4-dimethoxy-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.