Val-Leu-Arg-p-nitroanilide
TL;DR: Val-Leu-Arg-p-nitroanilide (CAS 64816-14-4) is a chemical compound with molecular formula C23H38N8O5 and molecular weight 506.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-N-[(2S)-5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]-4-methylpentanamide
Also Known As: Val-Leu-Arg-p-nitroanilide, D-Val-Leu-Arg-PNA, H-D-Val-Leu-Arg-pNA, D-VLR-PNA, D-Val-Leu-Arg-NH-Np
| Molecular Formula | C23H38N8O5 |
|---|---|
| Molecular Weight | 506.30 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 224.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 506.2965 |
| Heavy Atoms | 36 |
| Complexity | 771.0 |
Chemical Identifiers
| CAS Number | 64816-14-4 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)[C@@H](C(C)C)N |
| InChIKey | ZNKZJCICBFSACN-GBESFXJTSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Val-Leu-Arg-p-nitroanilide (CAS 64816-14-4), with molecular formula C23H38N8O5 and molecular weight 506.30 g/mol. IUPAC: (2S)-2-[[(2R)-2-amino-3-methylbutanoyl]amino]-N-[(2S)-5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]-4-methylpentanamide.
Chemical Property Profile of Val-Leu-Arg-p-nitroanilide
Property Insights of Val-Leu-Arg-p-nitroanilide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Val-Leu-Arg-p-nitroanilide. The TPSA of 224.0 Ų indicates high polarity, suggesting Val-Leu-Arg-p-nitroanilide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Val-Leu-Arg-p-nitroanilide has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Val-Leu-Arg-p-nitroanilide?
The CAS number of Val-Leu-Arg-p-nitroanilide is 64816-14-4.
What is the molecular formula of Val-Leu-Arg-p-nitroanilide?
The molecular formula of Val-Leu-Arg-p-nitroanilide is C23H38N8O5.
What is the molecular weight of Val-Leu-Arg-p-nitroanilide?
The molecular weight of Val-Leu-Arg-p-nitroanilide is 506.30 g/mol.
Where can I buy Val-Leu-Arg-p-nitroanilide?
You can request a quote for Val-Leu-Arg-p-nitroanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Val-Leu-Arg-p-nitroanilide?
Yes, KEHONG BIO provides custom synthesis services for Val-Leu-Arg-p-nitroanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.