Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-
TL;DR: Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- (CAS 66596-66-5) is a chemical compound with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-9-ethoxy-2-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13),9-pentaene
Also Known As: Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-, 9-Chloro-7-ethoxy-2-methyl-4,5-dihydroimidazo(4,5,1-jk)(1,4)benzodiazepine, 9-Chloro-7-ethoxy-2-methyl-4,5-dihydroimidazo[4,5,1-jk][1,4]benzodiazepine, BRN 0665526, RefChem:348807
| Molecular Formula | C13H14ClN3O |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 2.79482 |
| Topological Polar Surface Area | 39.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.08255 |
| Heavy Atoms | 18 |
| Complexity | 645.21405 |
Chemical Identifiers
| CAS Number | 66596-66-5 |
|---|---|
| SMILES | CCOC1=NCCN2C(=NC3=CC(=CC1=C32)Cl)C |
Product Overview
Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- (CAS 66596-66-5), with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol. IUPAC: 6-chloro-9-ethoxy-2-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13),9-pentaene.
Chemical Property Profile of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-
Property Insights of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-
The XLogP value of 2.79482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-. With a topological polar surface area (TPSA) of 39.41 Ų, Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-?
The CAS number of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- is 66596-66-5.
What is the molecular formula of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-?
The molecular formula of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- is C13H14ClN3O.
What is the molecular weight of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-?
The molecular weight of Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- is 263.08 g/mol.
Where can I buy Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-?
You can request a quote for Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Imidazo(4,5,1-jk)(1,4)benzodiazepine, 4,5-dihydro-9-chloro-7-ethoxy-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.