![N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide structure](/static/products/799/799780-10-2.png)
N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide
TL;DR: N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide (CAS 799780-10-2) is a chemical compound with molecular formula C27H28N6O2 and molecular weight 468.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(13-hexyl-14-methyl-12-oxo-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-17-yl)phenyl]acetamide
Also Known As: N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide, N-[4-(3-hexyl-2-methyl-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl)phenyl]acetamide
| Molecular Formula | C27H28N6O2 |
|---|---|
| Molecular Weight | 468.23 g/mol |
| LogP | 5.13072 |
| Topological Polar Surface Area | 94.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.2274 |
| Heavy Atoms | 35 |
| Complexity | 1615.2402 |
Chemical Identifiers
| CAS Number | 799780-10-2 |
|---|---|
| SMILES | CCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)NC(=O)C)C |
Product Overview
N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide (CAS 799780-10-2), with molecular formula C27H28N6O2 and molecular weight 468.23 g/mol. IUPAC: N-[4-(13-hexyl-14-methyl-12-oxo-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-17-yl)phenyl]acetamide.
Chemical Property Profile of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide
Property Insights of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide
The XLogP value of 5.13072 indicates that N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide. Following Lipinski's Rule of Five, N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide?
The CAS number of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide is 799780-10-2.
What is the molecular formula of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide?
The molecular formula of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide is C27H28N6O2.
What is the molecular weight of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide?
The molecular weight of N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide is 468.23 g/mol.
Where can I buy N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide?
You can request a quote for N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(3-hexyl-2-methyl-4-oxo-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11(4H)-yl)phenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.