1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
TL;DR: 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 577999-60-1) is a chemical compound with molecular formula C18H21N5O and molecular weight 323.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-butan-2-yl-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, VU0604785-1, 2-amino-N-(butan-2-yl)-1-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, F3225-3139, 2-amino-N-butan-2-yl-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxamide
| Molecular Formula | C18H21N5O |
|---|---|
| Molecular Weight | 323.17 g/mol |
| LogP | 2.881 |
| Topological Polar Surface Area | 85.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.17462 |
| Heavy Atoms | 24 |
| Complexity | 927.9448 |
Chemical Identifiers
| CAS Number | 577999-60-1 |
|---|---|
| SMILES | CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)N |
Product Overview
1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 577999-60-1), with molecular formula C18H21N5O and molecular weight 323.17 g/mol. IUPAC: 2-amino-N-butan-2-yl-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Property Insights of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
The XLogP value of 2.881 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide. The TPSA of 85.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide. Following Lipinski's Rule of Five, 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide has 2 hydrogen bond donor(s) and 4 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 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The CAS number of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 577999-60-1.
What is the molecular formula of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular formula of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is C18H21N5O.
What is the molecular weight of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular weight of 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 323.17 g/mol.
Where can I buy 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
You can request a quote for 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-allyl-2-amino-N-(sec-butyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.