2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one
TL;DR: 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one (CAS 63563-63-3) is a chemical compound with molecular formula C14H13NOSe and molecular weight 291.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one
Also Known As: 2,4-dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one, (6E)-2,4-dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-o, (6E)-2,4-dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one, 3,5-Cyclohexadiene-1,2-dione,3,5-dimethyl-, 1-(Se-phenylselenooxime)
| Molecular Formula | C14H13NOSe |
|---|---|
| Molecular Weight | 291.02 g/mol |
| LogP | 1.8474 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.01624 |
| Heavy Atoms | 17 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 63563-63-3 |
|---|---|
| SMILES | CC1=CC(=N[Se]C2=CC=CC=C2)C(=O)C(=C1)C |
| InChIKey | VCWCWNOJOGHPIG-UHFFFAOYSA-N |
Product Overview
2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one (CAS 63563-63-3), with molecular formula C14H13NOSe and molecular weight 291.02 g/mol. IUPAC: 2,4-dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one.
Chemical Property Profile of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one
Property Insights of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one
The XLogP value of 1.8474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one. With a topological polar surface area (TPSA) of 29.4 Ų, 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one 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 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one?
The CAS number of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one is 63563-63-3.
What is the molecular formula of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one?
The molecular formula of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one is C14H13NOSe.
What is the molecular weight of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one?
The molecular weight of 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one is 291.02 g/mol.
Where can I buy 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one?
You can request a quote for 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethyl-6-phenylselanyliminocyclohexa-2,4-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.