3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one
TL;DR: 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one (CAS 690641-45-3) is a chemical compound with molecular formula C16H14N2O4S and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-6-(hydroxymethyl)-2-[(pyridin-2-ylamino)-thiophen-3-ylmethyl]pyran-4-one
Also Known As: 3-hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one, 3-hydroxy-6-(hydroxymethyl)-2-[(pyridin-2-ylamino)(thien-3-yl)methyl]-4H-pyran-4-one, 3-hydroxy-6-(hydroxymethyl)-2-[(pyridin-2-ylamino)-thiophen-3-ylmethyl]pyran-4-one
| Molecular Formula | C16H14N2O4S |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 2.4957 |
| Topological Polar Surface Area | 95.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.0674 |
| Heavy Atoms | 23 |
| Complexity | 831.0415 |
Chemical Identifiers
| CAS Number | 690641-45-3 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(C2=CSC=C2)C3=C(C(=O)C=C(O3)CO)O |
Product Overview
3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one (CAS 690641-45-3), with molecular formula C16H14N2O4S and molecular weight 330.07 g/mol. IUPAC: 3-hydroxy-6-(hydroxymethyl)-2-[(pyridin-2-ylamino)-thiophen-3-ylmethyl]pyran-4-one.
Chemical Property Profile of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one
Property Insights of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one
The XLogP value of 2.4957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one. The TPSA of 95.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one. Following Lipinski's Rule of Five, 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one has 3 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 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one?
The CAS number of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one is 690641-45-3.
What is the molecular formula of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one?
The molecular formula of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one is C16H14N2O4S.
What is the molecular weight of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one?
The molecular weight of 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one is 330.07 g/mol.
Where can I buy 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one?
You can request a quote for 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-6-(hydroxymethyl)-2-[(2-pyridylamino)-3-thienylmethyl]pyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.