C21H14BrN5O4
TL;DR: C21H14BrN5O4 (CAS 307330-29-6) is a chemical compound with molecular formula C21H14BrN5O4 and molecular weight 479.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-bromo-4-phenylquinazolin-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]acetamide
Also Known As: BAS 00225195, A1149/0053740, N-(6-bromo-4-phenylquinazolin-2-yl)-N'-[(E)-(5-nitrofuran-2-yl)methylidene]acetohydrazide, (E)-N-(6-bromo-4-phenylquinazolin-2-yl)-N'-((5-nitrofuran-2-yl)methylene)acetohydrazide
| Molecular Formula | C21H14BrN5O4 |
|---|---|
| Molecular Weight | 479.02 g/mol |
| LogP | 4.9475 |
| Topological Polar Surface Area | 114.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 479.02292 |
| Heavy Atoms | 31 |
| Complexity | 1320.1117 |
Chemical Identifiers
| CAS Number | 307330-29-6 |
|---|---|
| SMILES | CC(=O)N(C1=NC2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3)/N=C/C4=CC=C(O4)[N+](=O)[O-] |
Product Overview
C21H14BrN5O4 (CAS 307330-29-6), with molecular formula C21H14BrN5O4 and molecular weight 479.02 g/mol. IUPAC: N-(6-bromo-4-phenylquinazolin-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]acetamide.
Chemical Property Profile of C21H14BrN5O4
Property Insights of C21H14BrN5O4
The XLogP value of 4.9475 indicates that C21H14BrN5O4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.73 Ų falls within the moderate polarity range, balancing permeability and solubility for C21H14BrN5O4. Following Lipinski's Rule of Five, C21H14BrN5O4 has 0 hydrogen bond donor(s) and 7 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 C21H14BrN5O4?
The CAS number of C21H14BrN5O4 is 307330-29-6.
What is the molecular formula of C21H14BrN5O4?
The molecular formula of C21H14BrN5O4 is C21H14BrN5O4.
What is the molecular weight of C21H14BrN5O4?
The molecular weight of C21H14BrN5O4 is 479.02 g/mol.
Where can I buy C21H14BrN5O4?
You can request a quote for C21H14BrN5O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C21H14BrN5O4?
Yes, KEHONG BIO provides custom synthesis services for C21H14BrN5O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.