6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one
TL;DR: 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one (CAS 91911-79-4) is a chemical compound with molecular formula C13H15ClN2O4 and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one
Also Known As: 6-chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one, 6-Chloro-3,4-bis[(2-hydroxyethyl)amino]-2H-1-benzopyran-2-one
| Molecular Formula | C13H15ClN2O4 |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 90.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.07202 |
| Heavy Atoms | 20 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 91911-79-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C(=C(C(=O)O2)NCCO)NCCO |
| InChIKey | SFYLLWKYPQNBBN-UHFFFAOYSA-N |
Product Overview
6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one (CAS 91911-79-4), with molecular formula C13H15ClN2O4 and molecular weight 298.07 g/mol. IUPAC: 6-chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one.
Chemical Property Profile of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one
Property Insights of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one. Following Lipinski's Rule of Five, 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one has 4 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 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one?
The CAS number of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one is 91911-79-4.
What is the molecular formula of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one?
The molecular formula of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one is C13H15ClN2O4.
What is the molecular weight of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one?
The molecular weight of 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one is 298.07 g/mol.
Where can I buy 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one?
You can request a quote for 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-3,4-bis(2-hydroxyethylamino)chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.