3H-Indole, 5-chloro-2,3,3-trimethyl-
TL;DR: 3H-Indole, 5-chloro-2,3,3-trimethyl- (CAS 25981-83-3) is a chemical compound with molecular formula C11H12ClN and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2,3,3-trimethylindole
Also Known As: 5-Chloro-2,3,3-trimethyl-3H-indole, staurosporine, 5-chloro-2,3,3-trimethylindole, 3H-Indole, 5-chloro-2,3,3-trimethyl-, 5-Chloro-2,3,3-trimethylindolenine
| Molecular Formula | C11H12ClN |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 193.06583 |
| Heavy Atoms | 13 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 25981-83-3 |
|---|---|
| SMILES | CC1=NC2=C(C1(C)C)C=C(C=C2)Cl |
| InChIKey | GSKATGIMEUGNJN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3H-Indole, 5-chloro-2,3,3-trimethyl- (CAS 25981-83-3), with molecular formula C11H12ClN and molecular weight 193.07 g/mol. IUPAC: 5-chloro-2,3,3-trimethylindole.
Chemical Property Profile of 3H-Indole, 5-chloro-2,3,3-trimethyl-
Property Insights of 3H-Indole, 5-chloro-2,3,3-trimethyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Indole, 5-chloro-2,3,3-trimethyl-. With a topological polar surface area (TPSA) of 12.4 Ų, 3H-Indole, 5-chloro-2,3,3-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Indole, 5-chloro-2,3,3-trimethyl- 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 3H-Indole, 5-chloro-2,3,3-trimethyl-?
The CAS number of 3H-Indole, 5-chloro-2,3,3-trimethyl- is 25981-83-3.
What is the molecular formula of 3H-Indole, 5-chloro-2,3,3-trimethyl-?
The molecular formula of 3H-Indole, 5-chloro-2,3,3-trimethyl- is C11H12ClN.
What is the molecular weight of 3H-Indole, 5-chloro-2,3,3-trimethyl-?
The molecular weight of 3H-Indole, 5-chloro-2,3,3-trimethyl- is 193.07 g/mol.
Where can I buy 3H-Indole, 5-chloro-2,3,3-trimethyl-?
You can request a quote for 3H-Indole, 5-chloro-2,3,3-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Indole, 5-chloro-2,3,3-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Indole, 5-chloro-2,3,3-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.