Benzoselenazole, 2,5-dimethyl-
TL;DR: Benzoselenazole, 2,5-dimethyl- (CAS 2818-89-5) is a chemical compound with molecular formula C9H9NSe and molecular weight 210.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyl-1,3-benzoselenazole
Also Known As: 2,5-Dimethylbenzoselenazole, Benzoselenazole, 2,5-dimethyl-, 2,5-Dimethylbenzselenazole, 2,4-dimethyl-1,3-benzoselenazole, 2,5-Dimethylbenzselenazol
| Molecular Formula | C9H9NSe |
|---|---|
| Molecular Weight | 210.99 g/mol |
| LogP | 1.91 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.99002 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 2818-89-5 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)[Se]C(=N2)C |
| InChIKey | QOCDXWOQEUNOQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoselenazole, 2,5-dimethyl- (CAS 2818-89-5), with molecular formula C9H9NSe and molecular weight 210.99 g/mol. IUPAC: 2,4-dimethyl-1,3-benzoselenazole.
Chemical Property Profile of Benzoselenazole, 2,5-dimethyl-
Property Insights of Benzoselenazole, 2,5-dimethyl-
The XLogP value of 1.91 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoselenazole, 2,5-dimethyl-. With a topological polar surface area (TPSA) of 12.9 Ų, Benzoselenazole, 2,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoselenazole, 2,5-dimethyl- has 0 hydrogen bond donor(s) and 1 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 Benzoselenazole, 2,5-dimethyl-?
The CAS number of Benzoselenazole, 2,5-dimethyl- is 2818-89-5.
What is the molecular formula of Benzoselenazole, 2,5-dimethyl-?
The molecular formula of Benzoselenazole, 2,5-dimethyl- is C9H9NSe.
What is the molecular weight of Benzoselenazole, 2,5-dimethyl-?
The molecular weight of Benzoselenazole, 2,5-dimethyl- is 210.99 g/mol.
Where can I buy Benzoselenazole, 2,5-dimethyl-?
You can request a quote for Benzoselenazole, 2,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoselenazole, 2,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzoselenazole, 2,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.