N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide
TL;DR: N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide (CAS 1003761-45-2) is a chemical compound with molecular formula C14H16N4O4 and molecular weight 304.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylpropyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide
Also Known As: N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide, N-(2-methylpropyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide, N-(2-methylpropyl)-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide
| Molecular Formula | C14H16N4O4 |
|---|---|
| Molecular Weight | 304.12 g/mol |
| LogP | 1.0769 |
| Topological Polar Surface Area | 107.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.11716 |
| Heavy Atoms | 22 |
| Complexity | 781.99677 |
Chemical Identifiers
| CAS Number | 1003761-45-2 |
|---|---|
| SMILES | CC(C)CNC(=O)CN1C=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-] |
Product Overview
N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide (CAS 1003761-45-2), with molecular formula C14H16N4O4 and molecular weight 304.12 g/mol. IUPAC: N-(2-methylpropyl)-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide.
Chemical Property Profile of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide
Property Insights of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide
The XLogP value of 1.0769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide. The TPSA of 107.13 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide. Following Lipinski's Rule of Five, N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide has 1 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-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide?
The CAS number of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide is 1003761-45-2.
What is the molecular formula of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide?
The molecular formula of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide is C14H16N4O4.
What is the molecular weight of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide?
The molecular weight of N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide is 304.12 g/mol.
Where can I buy N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide?
You can request a quote for N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-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-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-isobutyl-2-(6-nitro-4-oxoquinazolin-3(4H)-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.