Esculamine
TL;DR: Esculamine (CAS 2908-75-0) is a chemical compound with molecular formula C15H19NO6 and molecular weight 309.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[[bis(2-hydroxyethyl)amino]methyl]-6,7-dihydroxy-4-methylchromen-2-one
Also Known As: Esculamine, Esculamina, Esculaminum, Esculamine [INN], Esculaminum [INN-Latin]
| Molecular Formula | C15H19NO6 |
|---|---|
| Molecular Weight | 309.12 g/mol |
| LogP | 0.29922 |
| Topological Polar Surface Area | 114.37 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.12125 |
| Heavy Atoms | 22 |
| Complexity | 718.02496 |
Chemical Identifiers
| CAS Number | 2908-75-0 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C(C(=C(C=C12)O)O)CN(CCO)CCO |
Product Overview
Esculamine (CAS 2908-75-0), with molecular formula C15H19NO6 and molecular weight 309.12 g/mol. IUPAC: 8-[[bis(2-hydroxyethyl)amino]methyl]-6,7-dihydroxy-4-methylchromen-2-one.
Chemical Property Profile of Esculamine
Property Insights of Esculamine
The XLogP value of 0.29922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Esculamine. The TPSA of 114.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Esculamine. Following Lipinski's Rule of Five, Esculamine has 4 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 Esculamine?
The CAS number of Esculamine is 2908-75-0.
What is the molecular formula of Esculamine?
The molecular formula of Esculamine is C15H19NO6.
What is the molecular weight of Esculamine?
The molecular weight of Esculamine is 309.12 g/mol.
Where can I buy Esculamine?
You can request a quote for Esculamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Esculamine?
Yes, KEHONG BIO provides custom synthesis services for Esculamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.