1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
TL;DR: 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline (CAS 139655-03-1) is a chemical compound with molecular formula C17H15ClN2 and molecular weight 282.09238 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Also Known As: ILKMFTINEKPIRM-UHFFFAOYSA-, 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline, 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline hydrochloride, 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole, J2.121.342J
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H15ClN2 |
| Molecular Weight | 282.09238 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 27.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.09238 Da |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
| SMILES | C1CNC(C2=C1C3=CC=CC=C3N2)C4=CC=C(C=C4)Cl |
| InChIKey | ILKMFTINEKPIRM-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
Property Insights of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline
The XLogP value of 3.8 indicates that 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.8 Ų, 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
The CAS number of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is 139655-03-1.
What is the molecular formula of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
The molecular formula of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is C17H15ClN2.
What is the molecular weight of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
The molecular weight of 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline is 282.09238 g/mol.
Where can I buy 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
You can request a quote for 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline?
Yes, CoreyChem provides custom synthesis services for 1-(4-chlorophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.