3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide
TL;DR: 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide (CAS 91396-23-5) is a chemical compound with molecular formula C12H12ClN3O2 and molecular weight 265.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(2-chlorophenyl)methyl]-5-methyl-1,2-oxazole-3-carbohydrazide
Also Known As: 3-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-, 2-(o-CHLOROBENZYL)HYDRAZIDE, N'-(2-Chlorobenzyl)-5-methylisoxazole-3-carbohydrazide, 5-Methyl-3-isoxazolecarboxylic acid 2-(o-chlorobenzyl)hydrazide, N'-[(2-chlorophenyl)methyl]-5-methyl-1,2-oxazole-3-carbohydrazide, N -(2-Chlorobenzyl)-5-methyl-3-isoxazolecarbohydrazide
| Molecular Formula | C12H12ClN3O2 |
|---|---|
| Molecular Weight | 265.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.0618 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 91396-23-5 |
|---|---|
| SMILES | CC1=CC(=NO1)C(=O)NNCC2=CC=CC=C2Cl |
| InChIKey | BQKPYJPXNTYNQV-UHFFFAOYSA-N |
Product Overview
3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide (CAS 91396-23-5), with molecular formula C12H12ClN3O2 and molecular weight 265.06 g/mol. IUPAC: N'-[(2-chlorophenyl)methyl]-5-methyl-1,2-oxazole-3-carbohydrazide.
Chemical Property Profile of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide
Property Insights of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide. Following Lipinski's Rule of Five, 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide 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-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide?
The CAS number of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide is 91396-23-5.
What is the molecular formula of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide?
The molecular formula of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide is C12H12ClN3O2.
What is the molecular weight of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide?
The molecular weight of 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide is 265.06 g/mol.
Where can I buy 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide?
You can request a quote for 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(o-chlorobenzyl)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.