Kievitone hydrate
TL;DR: Kievitone hydrate (CAS 62682-11-5) is a chemical compound with molecular formula C20H22O7 and molecular weight 374.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydrochromen-4-one
Also Known As: Kievitone hydrate, J2.738.941D, 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydro-4H-chromen-4-one, 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydrochromen-4-one, 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-3,4-dihydro-2H-1-benzopyran-4-one
| Molecular Formula | C20H22O7 |
|---|---|
| Molecular Weight | 374.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.13657 |
| Heavy Atoms | 27 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 62682-11-5 |
|---|---|
| SMILES | CC(C)(CCC1=C2C(=C(C=C1O)O)C(=O)C(CO2)C3=C(C=C(C=C3)O)O)O |
| InChIKey | QISUKJAAXYVLMA-UHFFFAOYSA-N |
Product Overview
Kievitone hydrate (CAS 62682-11-5), with molecular formula C20H22O7 and molecular weight 374.14 g/mol. IUPAC: 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydrochromen-4-one.
Chemical Property Profile of Kievitone hydrate
Property Insights of Kievitone hydrate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Kievitone hydrate. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Kievitone hydrate. Following Lipinski's Rule of Five, Kievitone hydrate has 5 hydrogen bond donor(s) and 7 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 Kievitone hydrate?
The CAS number of Kievitone hydrate is 62682-11-5.
What is the molecular formula of Kievitone hydrate?
The molecular formula of Kievitone hydrate is C20H22O7.
What is the molecular weight of Kievitone hydrate?
The molecular weight of Kievitone hydrate is 374.14 g/mol.
Where can I buy Kievitone hydrate?
You can request a quote for Kievitone hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kievitone hydrate?
Yes, KEHONG BIO provides custom synthesis services for Kievitone hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.