![N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide structure](/static/products/4571/4571-56-6.webp)
N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
TL;DR: N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide (CAS 4571-56-6) is a chemical compound with molecular formula C23H28N4O3 and molecular weight 408.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-ethylanilino)-3-oxopropyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
Also Known As: N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
| Molecular Formula | C23H28N4O3 |
|---|---|
| Molecular Weight | 408.22 g/mol |
| LogP | 2.5682 |
| Topological Polar Surface Area | 83.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.21616 |
| Heavy Atoms | 30 |
| Complexity | 982.68787 |
Chemical Identifiers
| CAS Number | 4571-56-6 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CCNC(=O)N2CC3CC(C2)C4=CC=CC(=O)N4C3 |
Product Overview
N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide (CAS 4571-56-6), with molecular formula C23H28N4O3 and molecular weight 408.22 g/mol. IUPAC: N-[3-(4-ethylanilino)-3-oxopropyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide.
Chemical Property Profile of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Property Insights of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
The XLogP value of 2.5682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide. The TPSA of 83.44 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide. Following Lipinski's Rule of Five, N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide 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-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?
The CAS number of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide is 4571-56-6.
What is the molecular formula of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?
The molecular formula of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide is C23H28N4O3.
What is the molecular weight of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?
The molecular weight of N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide is 408.22 g/mol.
Where can I buy N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?
You can request a quote for N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(4-Ethylanilino)-3-oxopropyl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.