1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-
TL;DR: 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- (CAS 138023-40-2) is a chemical compound with molecular formula C10H11IN2 and molecular weight 286.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodo-1,8-diazatricyclo[6.2.2.02,7]dodeca-2(7),3,5-triene
Also Known As: 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-, 3'-Iodobenzo-1,4-diazabicyclooctene, 5-IODO-2,3-DIHYDRO-1,4-ETHANOQUINOXALINE, 3'-Iodobenzo[1',2'-b]-1,4-diazabicyclo[2.2.2]octene, 3'-Iodobenzo(1',2'-b)-1,4-diazabicyclo[2.2.2]octene
| Molecular Formula | C10H11IN2 |
|---|---|
| Molecular Weight | 286.00 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.9967 |
| Heavy Atoms | 13 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 138023-40-2 |
|---|---|
| SMILES | C1CN2CCN1C3=C2C(=CC=C3)I |
| InChIKey | XAJAZEGOKNWPLB-UHFFFAOYSA-N |
Product Overview
1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- (CAS 138023-40-2), with molecular formula C10H11IN2 and molecular weight 286.00 g/mol. IUPAC: 3-iodo-1,8-diazatricyclo[6.2.2.02,7]dodeca-2(7),3,5-triene.
Chemical Property Profile of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-
Property Insights of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-. With a topological polar surface area (TPSA) of 6.5 Ų, 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- has 0 hydrogen bond donor(s) and 2 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 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-?
The CAS number of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- is 138023-40-2.
What is the molecular formula of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-?
The molecular formula of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- is C10H11IN2.
What is the molecular weight of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-?
The molecular weight of 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- is 286.00 g/mol.
Where can I buy 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-?
You can request a quote for 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Ethanoquinoxaline, 2,3-dihydro-5-iodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.