![3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one structure](/static/products/1393/139394-07-3.webp)
3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one
TL;DR: 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one (CAS 139394-07-3) is a chemical compound with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one
Also Known As: 2-Pyridinone deriv., 2-Pyridinone derivative 41, 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one, 3-[(2-Benzoxazolylamino)methyl]-5-ethyl-6-methyl-2(1H)-pyridinone, 3-[[(Benzoxazol-2-yl)amino]methyl]-5-ethyl-6-methylpyridin-2(1H)-one
| Molecular Formula | C16H17N3O2 |
|---|---|
| Molecular Weight | 283.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.13208 |
| Heavy Atoms | 21 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 139394-07-3 |
|---|---|
| SMILES | CCC1=C(NC(=O)C(=C1)CNC2=NC3=CC=CC=C3O2)C |
| InChIKey | JOJRZHBMXFTUHG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one (CAS 139394-07-3), with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol. IUPAC: 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one.
Chemical Property Profile of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one
Property Insights of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one. Following Lipinski's Rule of Five, 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one has 2 hydrogen bond donor(s) and 4 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-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one?
The CAS number of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one is 139394-07-3.
What is the molecular formula of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one?
The molecular formula of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one is C16H17N3O2.
What is the molecular weight of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one?
The molecular weight of 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one is 283.13 g/mol.
Where can I buy 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one?
You can request a quote for 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(1,3-benzoxazol-2-ylamino)methyl]-5-ethyl-6-methyl-1H-pyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.