(4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride
TL;DR: (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride (CAS 67953-08-6) is a chemical compound with molecular formula C11H14ClN3O5 and molecular weight 303.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride
Also Known As: H-Glu(PNA)-OH.HCl, L-Glutamyl-p-nitroanilide, hydrochloride, n-(4-amino-1-carboxy-4-oxobutyl)-4-nitroanilinium chloride, N-(3-carbamoyl-1-carboxypropyl)-4-nitroanilinium chloride, N-(3-carbamoyl-1-carboxypropyl)-4-nitroanilinium chloride
| Molecular Formula | C11H14ClN3O5 |
|---|---|
| Molecular Weight | 303.06 g/mol |
| LogP | -3.49 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 303.0622 |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 67953-08-6 |
|---|---|
| SMILES | C1=CC(=CC=C1[NH2+]C(CCC(=O)N)C(=O)O)[N+](=O)[O-].[Cl-] |
| InChIKey | WMRCHNNHOJNRSL-UHFFFAOYSA-N |
Product Overview
(4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride (CAS 67953-08-6), with molecular formula C11H14ClN3O5 and molecular weight 303.06 g/mol. IUPAC: (4-amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride.
Chemical Property Profile of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride
Property Insights of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride
The XLogP value of -3.49 indicates that (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 143.0 Ų indicates high polarity, suggesting (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride has 3 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-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride?
The CAS number of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride is 67953-08-6.
What is the molecular formula of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride?
The molecular formula of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride is C11H14ClN3O5.
What is the molecular weight of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride?
The molecular weight of (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride is 303.06 g/mol.
Where can I buy (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride?
You can request a quote for (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride?
Yes, KEHONG BIO provides custom synthesis services for (4-Amino-1-carboxy-4-oxobutyl)-(4-nitrophenyl)azanium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.