(4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
TL;DR: (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate (CAS 2578-84-9) is a chemical compound with molecular formula C23H20N2O6 and molecular weight 420.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: Z-Phe-ONp, Z-D-PHE-ONP, Z-L-Phe-ONp, Z-L-phenylalanine 4-nitrophenyl ester, N-CBZ-D-Phenylalanine 4-nitrophenyl ester
| Molecular Formula | C23H20N2O6 |
|---|---|
| Molecular Weight | 420.13 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 420.13214 |
| Heavy Atoms | 31 |
| Complexity | 587.0 |
Chemical Identifiers
| CAS Number | 2578-84-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3 |
| InChIKey | TVENQUPLPBPLGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate (CAS 2578-84-9), with molecular formula C23H20N2O6 and molecular weight 420.13 g/mol. IUPAC: (4-nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Property Insights of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
The XLogP value of 4.7 indicates that (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate. Following Lipinski's Rule of Five, (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate has 1 hydrogen bond donor(s) and 6 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 (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate?
The CAS number of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate is 2578-84-9.
What is the molecular formula of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate?
The molecular formula of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate is C23H20N2O6.
What is the molecular weight of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate?
The molecular weight of (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate is 420.13 g/mol.
Where can I buy (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate?
You can request a quote for (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Nitrophenyl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.