RefChem:349867
TL;DR: RefChem:349867 (CAS 62206-00-2) is a chemical compound with molecular formula C25H23ClN2O2 and molecular weight 418.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-12,13-dimethoxy-6-phenyl-7,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepine
Also Known As: 2-Chloro-12,13-dimethoxy-6-phenyl-7,9,10,14-tetrahydroisoquino(2,1-d)(1,4)benzodiazepine, Isoquino(2,1-d)(1,4)benzodiazepine, 7,9,10,14b-tetrahydro-2-chloro-12,13-dimethoxy-6-phenyl-, 2-chloro-12,13-dimethoxy-6-phenyl-7,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepine, 7,9,10,14b-Tetrahydro-2-chloro-12,13-dimethoxy-6-phenylisoquino[2,1-d][1,4]benzodiazepine, 4-chloro-16,17-dimethoxy-9-phenyl-8,11-diazatetracyclo[9.8.0.02,7.014,19]nonadeca-2,4,6,8,14(19),15,17-heptaene
| Molecular Formula | C25H23ClN2O2 |
|---|---|
| Molecular Weight | 418.14 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.1448 |
| Heavy Atoms | 30 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 62206-00-2 |
|---|---|
| SMILES | COC1=C(C=C2C3C4=C(C=CC(=C4)Cl)N=C(CN3CCC2=C1)C5=CC=CC=C5)OC |
| InChIKey | JGKYITUCSFGHGO-UHFFFAOYSA-N |
Product Overview
RefChem:349867 (CAS 62206-00-2), with molecular formula C25H23ClN2O2 and molecular weight 418.14 g/mol. IUPAC: 2-chloro-12,13-dimethoxy-6-phenyl-7,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepine.
Chemical Property Profile of RefChem:349867
Property Insights of RefChem:349867
The XLogP value of 5.3 indicates that RefChem:349867 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, RefChem:349867 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349867 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 RefChem:349867?
The CAS number of RefChem:349867 is 62206-00-2.
What is the molecular formula of RefChem:349867?
The molecular formula of RefChem:349867 is C25H23ClN2O2.
What is the molecular weight of RefChem:349867?
The molecular weight of RefChem:349867 is 418.14 g/mol.
Where can I buy RefChem:349867?
You can request a quote for RefChem:349867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349867?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.