Novokinin
TL;DR: Novokinin (CAS 358738-77-9) is a chemical compound with molecular formula C39H61N11O7 and molecular weight 795.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoic acid
Also Known As: novokinin, Arg-Pro-Leu-Lys-Pro-Trp, Novokinin trifluoroacetate salt, HY-P0080, J1.543.541K
| Molecular Formula | C39H61N11O7 |
|---|---|
| Molecular Weight | 795.48 g/mol |
| LogP | -0.2126 |
| Topological Polar Surface Area | 297.45 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 21 |
| Exact Mass | 795.4755 |
| Heavy Atoms | 57 |
| Complexity | 1743.4161 |
Chemical Identifiers
| CAS Number | 358738-77-9 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCN=C(N)N)N |
Product Overview
Novokinin (CAS 358738-77-9), with molecular formula C39H61N11O7 and molecular weight 795.48 g/mol. IUPAC: (2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoic acid.
Chemical Property Profile of Novokinin
Property Insights of Novokinin
The XLogP value of -0.2126 indicates that Novokinin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 297.45 Ų indicates high polarity, suggesting Novokinin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Novokinin has 9 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Novokinin?
The CAS number of Novokinin is 358738-77-9.
What is the molecular formula of Novokinin?
The molecular formula of Novokinin is C39H61N11O7.
What is the molecular weight of Novokinin?
The molecular weight of Novokinin is 795.48 g/mol.
Where can I buy Novokinin?
You can request a quote for Novokinin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Novokinin?
Yes, KEHONG BIO provides custom synthesis services for Novokinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.