CTK5A4641
TL;DR: CTK5A4641 (CAS 561005-17-2) is a chemical compound with molecular formula C10H13N3O4 and molecular weight 239.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylideneamino]carbamate
Also Known As: 5,7,8-Trihydroxy-2-methyl-4H-1-benzopyran-4-one, methyl N-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]carbamate, Hydrazinecarboxylic acid, [[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylene]-, methyl ester (9CI), METHYL 2-{[3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYL(PYRIDIN-4-YL)]METHYLIDENE}HYDRAZINECARBOXYLATE
| Molecular Formula | C10H13N3O4 |
|---|---|
| Molecular Weight | 239.09 g/mol |
| LogP | 0.27782 |
| Topological Polar Surface Area | 104.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.0906 |
| Heavy Atoms | 17 |
| Complexity | 445.4223 |
Chemical Identifiers
| CAS Number | 561005-17-2 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C=NNC(=O)OC)CO |
Product Overview
CTK5A4641 (CAS 561005-17-2), with molecular formula C10H13N3O4 and molecular weight 239.09 g/mol. IUPAC: methyl N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylideneamino]carbamate.
Chemical Property Profile of CTK5A4641
Property Insights of CTK5A4641
The XLogP value of 0.27782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK5A4641. The TPSA of 104.04 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5A4641. Following Lipinski's Rule of Five, CTK5A4641 has 3 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 CTK5A4641?
The CAS number of CTK5A4641 is 561005-17-2.
What is the molecular formula of CTK5A4641?
The molecular formula of CTK5A4641 is C10H13N3O4.
What is the molecular weight of CTK5A4641?
The molecular weight of CTK5A4641 is 239.09 g/mol.
Where can I buy CTK5A4641?
You can request a quote for CTK5A4641 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5A4641?
Yes, KEHONG BIO provides custom synthesis services for CTK5A4641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.