MDL 28170
TL;DR: MDL 28170 (CAS 88191-49-5) is a chemical compound with molecular formula C15H22O10 and molecular weight 362.12 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-chromene-3,5,7-triol;tetrahydrate
Also Known As: MDL 28170, 2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-,tetrahydrate, (2R-trans)-, (2R,3S)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol--water (1/4), (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol tetrahydrate, 2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol--water (1/4)
| Molecular Formula | C15H22O10 |
|---|---|
| Molecular Weight | 362.12 g/mol |
| LogP | -1.7527 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.1213 |
| Heavy Atoms | 25 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 88191-49-5 |
|---|---|
| SMILES | C1[C@@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O.O.O.O.O |
| InChIKey | KGQDGODORNWSJK-XTFQXXJKSA-N |
Product Overview
MDL 28170 (CAS 88191-49-5), with molecular formula C15H22O10 and molecular weight 362.12 g/mol. IUPAC: (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol;tetrahydrate.
Chemical Property Profile of MDL 28170
Property Insights of MDL 28170
The XLogP value of -1.7527 indicates that MDL 28170 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for MDL 28170. Following Lipinski's Rule of Five, MDL 28170 has 9 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MDL 28170?
The CAS number of MDL 28170 is 88191-49-5.
What is the molecular formula of MDL 28170?
The molecular formula of MDL 28170 is C15H22O10.
What is the molecular weight of MDL 28170?
The molecular weight of MDL 28170 is 362.12 g/mol.
Where can I buy MDL 28170?
You can request a quote for MDL 28170 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MDL 28170?
Yes, KEHONG BIO provides custom synthesis services for MDL 28170 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.