N-(3,5-dinitrobenzoyl)leucine
TL;DR: N-(3,5-dinitrobenzoyl)leucine (CAS 7495-01-4) is a chemical compound with molecular formula C13H15N3O7 and molecular weight 325.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(3,5-dinitrobenzoyl)amino]-4-methylpentanoic acid
Also Known As: DNBL, N-(3,5-Dinitrobenzoyl)leucine, N-(3,5-Dinitrobenzoyl)-l-leucine, (S)-3,5-Dinitrobenzoylleucine, 3,5-dinitrobenzoyl-(S)-leucine
| Molecular Formula | C13H15N3O7 |
|---|---|
| Molecular Weight | 325.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.091 |
| Heavy Atoms | 23 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 7495-01-4 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | DIOBIOPCRMWGAT-NSHDSACASA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(3,5-dinitrobenzoyl)leucine (CAS 7495-01-4), with molecular formula C13H15N3O7 and molecular weight 325.09 g/mol. IUPAC: (2S)-2-[(3,5-dinitrobenzoyl)amino]-4-methylpentanoic acid.
Chemical Property Profile of N-(3,5-dinitrobenzoyl)leucine
Property Insights of N-(3,5-dinitrobenzoyl)leucine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,5-dinitrobenzoyl)leucine. The TPSA of 158.0 Ų indicates high polarity, suggesting N-(3,5-dinitrobenzoyl)leucine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(3,5-dinitrobenzoyl)leucine has 2 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 N-(3,5-dinitrobenzoyl)leucine?
The CAS number of N-(3,5-dinitrobenzoyl)leucine is 7495-01-4.
What is the molecular formula of N-(3,5-dinitrobenzoyl)leucine?
The molecular formula of N-(3,5-dinitrobenzoyl)leucine is C13H15N3O7.
What is the molecular weight of N-(3,5-dinitrobenzoyl)leucine?
The molecular weight of N-(3,5-dinitrobenzoyl)leucine is 325.09 g/mol.
Where can I buy N-(3,5-dinitrobenzoyl)leucine?
You can request a quote for N-(3,5-dinitrobenzoyl)leucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-dinitrobenzoyl)leucine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dinitrobenzoyl)leucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.