N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide
TL;DR: N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide (CAS 1219210-18-0) is a chemical compound with molecular formula C25H26N4O3 and molecular weight 430.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-(10-methyl-12,14-dioxo-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl)benzamide
Also Known As: N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide, N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1a(2),5a(2):1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide
| Molecular Formula | C25H26N4O3 |
|---|---|
| Molecular Weight | 430.20 g/mol |
| LogP | 4.1523 |
| Topological Polar Surface Area | 85.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.2005 |
| Heavy Atoms | 32 |
| Complexity | 1230.905 |
Chemical Identifiers
| CAS Number | 1219210-18-0 |
|---|---|
| SMILES | CCCCNC(=O)C1=CC=CC=C1N2C(=O)C3CC4=C(C(N3C2=O)C)NC5=CC=CC=C45 |
Product Overview
N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide (CAS 1219210-18-0), with molecular formula C25H26N4O3 and molecular weight 430.20 g/mol. IUPAC: N-butyl-2-(10-methyl-12,14-dioxo-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl)benzamide.
Chemical Property Profile of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide
Property Insights of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide
The XLogP value of 4.1523 indicates that N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.51 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide. Following Lipinski's Rule of Five, N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide has 2 hydrogen bond donor(s) and 3 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 N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide?
The CAS number of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide is 1219210-18-0.
What is the molecular formula of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide?
The molecular formula of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide is C25H26N4O3.
What is the molecular weight of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide?
The molecular weight of N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide is 430.20 g/mol.
Where can I buy N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide?
You can request a quote for N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-Butyl-2-(5,6,11,11a-tetrahydro-5-methyl-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.