N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide
TL;DR: N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide (CAS 859664-61-2) is a chemical compound with molecular formula C23H23N3O and molecular weight 357.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-1-(4-methylphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide
Also Known As: N-butyl-1-(p-tolyl)-9H-pyrido[3,4-b]indole-3-carboxamide, N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide, N-butyl-1-(4-methylphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide
| Molecular Formula | C23H23N3O |
|---|---|
| Molecular Weight | 357.18 g/mol |
| LogP | 5.22142 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.1841 |
| Heavy Atoms | 27 |
| Complexity | 1109.8441 |
Chemical Identifiers
| CAS Number | 859664-61-2 |
|---|---|
| SMILES | CCCCNC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=CC=C(C=C4)C |
Product Overview
N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide (CAS 859664-61-2), with molecular formula C23H23N3O and molecular weight 357.18 g/mol. IUPAC: N-butyl-1-(4-methylphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide.
Chemical Property Profile of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide
Property Insights of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide
The XLogP value of 5.22142 indicates that N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.78 Ų, N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide?
The CAS number of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide is 859664-61-2.
What is the molecular formula of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide?
The molecular formula of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide is C23H23N3O.
What is the molecular weight of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide?
The molecular weight of N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide is 357.18 g/mol.
Where can I buy N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide?
You can request a quote for N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-1-(4-methylphenyl)-9H-beta-carboline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.