N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m
TL;DR: N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m (CAS 116324-89-1) is a chemical compound with molecular formula C16H17N3O4 and molecular weight 315.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylideneamino]-4-methoxybenzamide
Also Known As: N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m, N'-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]-4-methoxybenzohydrazide
| Molecular Formula | C16H17N3O4 |
|---|---|
| Molecular Weight | 315.12 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.12192 |
| Heavy Atoms | 23 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 116324-89-1 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C=NNC(=O)C2=CC=C(C=C2)OC)CO |
| InChIKey | CLGBVQWRRPVQPL-UHFFFAOYSA-N |
Product Overview
N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m (CAS 116324-89-1), with molecular formula C16H17N3O4 and molecular weight 315.12 g/mol. IUPAC: N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylideneamino]-4-methoxybenzamide.
Chemical Property Profile of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m
Property Insights of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m. Following Lipinski's Rule of Five, N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m 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 N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m?
The CAS number of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m is 116324-89-1.
What is the molecular formula of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m?
The molecular formula of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m is C16H17N3O4.
What is the molecular weight of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m?
The molecular weight of N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m is 315.12 g/mol.
Where can I buy N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m?
You can request a quote for N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m?
Yes, KEHONG BIO provides custom synthesis services for N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]m and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.