3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole
TL;DR: 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole (CAS 2546-16-9) is a chemical compound with molecular formula C16H21N and molecular weight 227.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole
Also Known As: 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole, ZERENEX E/5046006, ChemDiv3_005775, NCIOpen2_005399, 3-tert-Butyl-1,2,3,4-tetrahydrocarbazole
| Molecular Formula | C16H21N |
|---|---|
| Molecular Weight | 227.17 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.1674 |
| Heavy Atoms | 17 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 2546-16-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)C3=CC=CC=C3N2 |
| InChIKey | IHQFCGFAJBMHHN-UHFFFAOYSA-N |
Product Overview
3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole (CAS 2546-16-9), with molecular formula C16H21N and molecular weight 227.17 g/mol. IUPAC: 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole.
Chemical Property Profile of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole
Property Insights of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole
The XLogP value of 4.7 indicates that 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.8 Ų, 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole has 1 hydrogen bond donor(s) and 0 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 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole?
The CAS number of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole is 2546-16-9.
What is the molecular formula of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole?
The molecular formula of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole is C16H21N.
What is the molecular weight of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole?
The molecular weight of 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole is 227.17 g/mol.
Where can I buy 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole?
You can request a quote for 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole?
Yes, KEHONG BIO provides custom synthesis services for 3-tert-butyl-2,3,4,9-tetrahydro-1H-carbazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.