N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide
TL;DR: N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide (CAS 415695-90-8) is a chemical compound with molecular formula C14H10BrN3O4 and molecular weight 362.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[amino-(3-nitrophenyl)methylidene]amino] 2-bromobenzoate
Also Known As: BIM-0018573.P001, AB00081266-01, (Z)-N'-((2-bromobenzoyl)oxy)-3-nitrobenzimidamide, N'-[(2-bromobenzoyl)oxy]-3-nitrobenzenecarboximidamide, [(Z)-[amino-(3-nitrophenyl)methylidene]amino] 2-bromobenzoate
| Molecular Formula | C14H10BrN3O4 |
|---|---|
| Molecular Weight | 362.99 g/mol |
| LogP | 2.8346 |
| Topological Polar Surface Area | 107.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.98547 |
| Heavy Atoms | 22 |
| Complexity | 761.2581 |
Chemical Identifiers
| CAS Number | 415695-90-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O/N=C(/C2=CC(=CC=C2)[N+](=O)[O-])\N)Br |
Product Overview
N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide (CAS 415695-90-8), with molecular formula C14H10BrN3O4 and molecular weight 362.99 g/mol. IUPAC: [(Z)-[amino-(3-nitrophenyl)methylidene]amino] 2-bromobenzoate.
Chemical Property Profile of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide
Property Insights of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide
The XLogP value of 2.8346 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide. The TPSA of 107.82 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide. Following Lipinski's Rule of Five, N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide 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'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide?
The CAS number of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide is 415695-90-8.
What is the molecular formula of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide?
The molecular formula of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide is C14H10BrN3O4.
What is the molecular weight of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide?
The molecular weight of N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide is 362.99 g/mol.
Where can I buy N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide?
You can request a quote for N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide?
Yes, KEHONG BIO provides custom synthesis services for N'-{[(2-bromophenyl)carbonyl]oxy}-3-nitrobenzenecarboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.