Dihydrotentoxin
TL;DR: Dihydrotentoxin (CAS 54987-63-2) is a chemical compound with molecular formula C22H32N4O4 and molecular weight 416.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methyl-N-[(2R)-2-(methylamino)-3-phenylpropanoyl]-2-[[(2S)-2-(methylamino)propanoyl]amino]-N-(2-oxoethyl)pent-4-enamide
Also Known As: Dihydrotentoxin, Cyclo(N-methyl-ala-leu-N-methyl-phe-gly), (2S)-4-methyl-N-[(2R)-2-(methylamino)-3-phenylpropanoyl]-2-[[(2S)-2-(methylamino)propanoyl]amino]-N-(2-oxoethyl)pent-4-enamide, Cyclo(N-methyl-alanyl-leucyl-N-methyl-phenylalanyl-glycyl), (2S)-4-methyl-N-((2R)-2-(methylamino)-3-phenylpropanoyl)-2-(((2S)-2-(methylamino)propanoyl)amino)-N-(2-oxoethyl)pent-4-enamide
| Molecular Formula | C22H32N4O4 |
|---|---|
| Molecular Weight | 416.24 g/mol |
| LogP | 0.4301 |
| Topological Polar Surface Area | 107.61 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 416.24237 |
| Heavy Atoms | 30 |
| Complexity | 750.7642 |
Chemical Identifiers
| CAS Number | 54987-63-2 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@@H](CC(=C)C)C(=O)N(CC=O)C(=O)[C@@H](CC1=CC=CC=C1)NC)NC |
Product Overview
Dihydrotentoxin (CAS 54987-63-2), with molecular formula C22H32N4O4 and molecular weight 416.24 g/mol. IUPAC: (2S)-4-methyl-N-[(2R)-2-(methylamino)-3-phenylpropanoyl]-2-[[(2S)-2-(methylamino)propanoyl]amino]-N-(2-oxoethyl)pent-4-enamide.
Chemical Property Profile of Dihydrotentoxin
Property Insights of Dihydrotentoxin
The XLogP value of 0.4301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydrotentoxin. The TPSA of 107.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydrotentoxin. Following Lipinski's Rule of Five, Dihydrotentoxin 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 Dihydrotentoxin?
The CAS number of Dihydrotentoxin is 54987-63-2.
What is the molecular formula of Dihydrotentoxin?
The molecular formula of Dihydrotentoxin is C22H32N4O4.
What is the molecular weight of Dihydrotentoxin?
The molecular weight of Dihydrotentoxin is 416.24 g/mol.
Where can I buy Dihydrotentoxin?
You can request a quote for Dihydrotentoxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrotentoxin?
Yes, KEHONG BIO provides custom synthesis services for Dihydrotentoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.