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Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide
TL;DR: Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide (CAS 6941-04-4) is a chemical compound with molecular formula C23H21N3O5 and molecular weight 419.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[1-(3-nitroanilino)-1-oxo-3-phenylpropan-2-yl]carbamate
Also Known As: A-[(benzyloxy)carbonyl]-n-(3-nitrophenyl)phenylalaninamide, Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide, benzyl N-[1-(3-nitroanilino)-1-oxo-3-phenylpropan-2-yl]carbamate
| Molecular Formula | C23H21N3O5 |
|---|---|
| Molecular Weight | 419.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.14813 |
| Heavy Atoms | 31 |
| Complexity | 597.0 |
Chemical Identifiers
| CAS Number | 6941-04-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3 |
| InChIKey | PCAGMSRCBQVUFB-UHFFFAOYSA-N |
Product Overview
Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide (CAS 6941-04-4), with molecular formula C23H21N3O5 and molecular weight 419.15 g/mol. IUPAC: benzyl N-[1-(3-nitroanilino)-1-oxo-3-phenylpropan-2-yl]carbamate.
Chemical Property Profile of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide
Property Insights of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide
The XLogP value of 4.2 indicates that Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide. Following Lipinski's Rule of Five, Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide has 2 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 Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide?
The CAS number of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide is 6941-04-4.
What is the molecular formula of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide?
The molecular formula of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide is C23H21N3O5.
What is the molecular weight of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide?
The molecular weight of Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide is 419.15 g/mol.
Where can I buy Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide?
You can request a quote for Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide?
Yes, KEHONG BIO provides custom synthesis services for Nalpha-[(benzyloxy)carbonyl]-N-(3-nitrophenyl)phenylalaninamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.