5-Dtnesu
TL;DR: 5-Dtnesu (CAS 114522-13-3) is a chemical compound with molecular formula C25H32O5 and molecular weight 412.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] decanoate
Also Known As: 5-Dtnesu, KST-1A0674, (2r,3s)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2h-chromen-3-yl decanoate, [(2S,3S)-2-(3,4-dihydroxyphenyl)chroman-3-yl] Decanoate, Decanoic acid, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-Benzopyran-3-yl ester, (2R-trans)-
| Molecular Formula | C25H32O5 |
|---|---|
| Molecular Weight | 412.22 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 412.22498 |
| Heavy Atoms | 30 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 114522-13-3 |
|---|---|
| SMILES | CCCCCCCCCC(=O)O[C@H]1CC2=CC=CC=C2O[C@@H]1C3=CC(=C(C=C3)O)O |
| InChIKey | HWJYOGRROZBGGH-UKILVPOCSA-N |
Product Overview
5-Dtnesu (CAS 114522-13-3), with molecular formula C25H32O5 and molecular weight 412.22 g/mol. IUPAC: [(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] decanoate.
Chemical Property Profile of 5-Dtnesu
Property Insights of 5-Dtnesu
The XLogP value of 6.8 indicates that 5-Dtnesu is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Dtnesu. Following Lipinski's Rule of Five, 5-Dtnesu has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Dtnesu?
The CAS number of 5-Dtnesu is 114522-13-3.
What is the molecular formula of 5-Dtnesu?
The molecular formula of 5-Dtnesu is C25H32O5.
What is the molecular weight of 5-Dtnesu?
The molecular weight of 5-Dtnesu is 412.22 g/mol.
Where can I buy 5-Dtnesu?
You can request a quote for 5-Dtnesu directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Dtnesu?
Yes, KEHONG BIO provides custom synthesis services for 5-Dtnesu and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.