2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide
TL;DR: 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide (CAS 100219-77-0) is a chemical compound with molecular formula C10H9ClN2O3 and molecular weight 240.03017 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide
Also Known As: 6-chloro-3-(methylcarbamoylmethyl)-2-benzoxazolone, 2-(6-Chloro-2-oxo-benzooxazol-3-yl)-N-methyl-acetamide, 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide
Technical Specifications
| Molecular Formula | C10H9ClN2O3 |
| Molecular Weight | 240.03017 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.03017 Da |
| Heavy Atoms | 16 |
| Complexity | 310.0 |
| SMILES | CNC(=O)CN1C2=C(C=C(C=C2)Cl)OC1=O |
| InChIKey | ZBFHIJJKDKKGRN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide
Property Insights of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide. With a topological polar surface area (TPSA) of 58.6 Ų, 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide?
The CAS number of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide is 100219-77-0.
What is the molecular formula of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide?
The molecular formula of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide is C10H9ClN2O3.
What is the molecular weight of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide?
The molecular weight of 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide is 240.03017 g/mol.
Where can I buy 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide?
You can request a quote for 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide?
Yes, CoreyChem provides custom synthesis services for 2-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.