N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide
TL;DR: N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide (CAS 6756-96-3) is a chemical compound with molecular formula C29H30N5O3+ and molecular weight 496.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide
Also Known As: N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide, 1-{2-[(1-Benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)amino]-2-oxoethyl}-4-(furan-2-carbonyl)piperazin-1-ium
| Molecular Formula | C29H30N5O3+ |
|---|---|
| Molecular Weight | 496.23 g/mol |
| LogP | 2.3699 |
| Topological Polar Surface Area | 83.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.23486 |
| Heavy Atoms | 37 |
| Complexity | 1412.5236 |
Chemical Identifiers
| CAS Number | 6756-96-3 |
|---|---|
| SMILES | C1CN(C2=NC3=CC=CC=C3C(=C21)NC(=O)C[NH+]4CCN(CC4)C(=O)C5=CC=CO5)CC6=CC=CC=C6 |
Product Overview
N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide (CAS 6756-96-3), with molecular formula C29H30N5O3+ and molecular weight 496.23 g/mol. IUPAC: N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide.
Chemical Property Profile of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide
Property Insights of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide
The XLogP value of 2.3699 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide. The TPSA of 83.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide. Following Lipinski's Rule of Five, N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide has 2 hydrogen bond donor(s) and 5 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-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide?
The CAS number of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide is 6756-96-3.
What is the molecular formula of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide?
The molecular formula of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide is C29H30N5O3+.
What is the molecular weight of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide?
The molecular weight of N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide is 496.23 g/mol.
Where can I buy N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide?
You can request a quote for N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-benzyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.