2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol
TL;DR: 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol (CAS 94071-13-3) is a chemical compound with molecular formula C15H20N2O and molecular weight 244.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)butan-1-ol
Also Known As: 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol, 2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE-1-BUTANOL, 4-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)butan-1-ol, 1-(4-hydroxybutyl)-3,4-dihydro-1H-pyrido[3,4-b]indole, 4-[(2,3,4,9-Tetrahydro-1H-pyrido[3,4-b]indol)-1-yl]-1-butanol
| Molecular Formula | C15H20N2O |
|---|---|
| Molecular Weight | 244.16 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 48.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.15756 |
| Heavy Atoms | 18 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 94071-13-3 |
|---|---|
| SMILES | C1CNC(C2=C1C3=CC=CC=C3N2)CCCCO |
| InChIKey | JGXRNUZQPOXGCW-UHFFFAOYSA-N |
Product Overview
2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol (CAS 94071-13-3), with molecular formula C15H20N2O and molecular weight 244.16 g/mol. IUPAC: 4-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)butan-1-ol.
Chemical Property Profile of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol
Property Insights of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol. With a topological polar surface area (TPSA) of 48.1 Ų, 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol has 3 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 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol?
The CAS number of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol is 94071-13-3.
What is the molecular formula of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol?
The molecular formula of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol is C15H20N2O.
What is the molecular weight of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol?
The molecular weight of 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol is 244.16 g/mol.
Where can I buy 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol?
You can request a quote for 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole-1-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.