Dansylhydrazide trivaline
TL;DR: Dansylhydrazide trivaline (CAS 76080-91-6) is a chemical compound with molecular formula C27H42N6O5S and molecular weight 562.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-N-[(2S)-1-[[(2S)-1-[2-[5-(dimethylamino)naphthalen-1-yl]sulfonylhydrazinyl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbutanamide
Also Known As: Dansylhydrazide trivaline, DGTV, Trivaline dansyl hydrazide, H-Val-val-val-N2H2-dns, Val-val-val-dansyl hydrazide
| Molecular Formula | C27H42N6O5S |
|---|---|
| Molecular Weight | 562.29 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 562.29376 |
| Heavy Atoms | 39 |
| Complexity | 949.0 |
Chemical Identifiers
| CAS Number | 76080-91-6 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NNS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C)N |
| InChIKey | AWIZJVIMVDVVFV-HJOGWXRNSA-N |
Product Overview
Dansylhydrazide trivaline (CAS 76080-91-6), with molecular formula C27H42N6O5S and molecular weight 562.29 g/mol. IUPAC: (2S)-2-amino-N-[(2S)-1-[[(2S)-1-[2-[5-(dimethylamino)naphthalen-1-yl]sulfonylhydrazinyl]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-3-methylbutanamide.
Chemical Property Profile of Dansylhydrazide trivaline
Property Insights of Dansylhydrazide trivaline
The XLogP value of 3.6 indicates that Dansylhydrazide trivaline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 171.0 Ų indicates high polarity, suggesting Dansylhydrazide trivaline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dansylhydrazide trivaline has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dansylhydrazide trivaline?
The CAS number of Dansylhydrazide trivaline is 76080-91-6.
What is the molecular formula of Dansylhydrazide trivaline?
The molecular formula of Dansylhydrazide trivaline is C27H42N6O5S.
What is the molecular weight of Dansylhydrazide trivaline?
The molecular weight of Dansylhydrazide trivaline is 562.29 g/mol.
Where can I buy Dansylhydrazide trivaline?
You can request a quote for Dansylhydrazide trivaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dansylhydrazide trivaline?
Yes, KEHONG BIO provides custom synthesis services for Dansylhydrazide trivaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.