Gentisamide, N-methyl-
TL;DR: Gentisamide, N-methyl- (CAS 63938-50-1) is a chemical compound with molecular formula C8H9NO3 and molecular weight 167.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-dihydroxy-N-methylbenzamide
Also Known As: N-Methylgentisamide, 2,5-dihydroxy-n-methylbenzamide, Gentisamide, N-methyl-, benzamide, 2,5-dihydroxy-N-methyl-, 4-10-00-01448 (Beilstein Handbook Reference)
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H9NO3 |
| Molecular Weight | 167.05824 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.05824 Da |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
| SMILES | CNC(=O)C1=C(C=CC(=C1)O)O |
| InChIKey | WQZUEUHQLFUVOF-UHFFFAOYSA-N |
Chemical Property Profile of Gentisamide, N-methyl-
Property Insights of Gentisamide, N-methyl-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Gentisamide, N-methyl-. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Gentisamide, N-methyl-. Following Lipinski's Rule of Five, Gentisamide, N-methyl- has 3 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 Gentisamide, N-methyl-?
The CAS number of Gentisamide, N-methyl- is 63938-50-1.
What is the molecular formula of Gentisamide, N-methyl-?
The molecular formula of Gentisamide, N-methyl- is C8H9NO3.
What is the molecular weight of Gentisamide, N-methyl-?
The molecular weight of Gentisamide, N-methyl- is 167.05824 g/mol.
Where can I buy Gentisamide, N-methyl-?
You can request a quote for Gentisamide, N-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Gentisamide, N-methyl-?
Yes, CoreyChem provides custom synthesis services for Gentisamide, N-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.