![3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid structure](/static/products/890/890981-42-7.webp)
3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid
TL;DR: 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid (CAS 890981-42-7) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(cyclohexanecarbonylamino)-4-methylbenzoic acid
Also Known As: 3-(cyclohexanecarboxamido)-4-methylbenzoic acid, 3-(cyclohexanecarbonylamino)-4-methyl-benzoic Acid, 3-(cyclohexanecarbonylamino)-4-methylbenzoic acid, 3-[(cyclohexylcarbonyl)amino]-4-methylbenzoic acid
Technical Specifications
| Molecular Formula | C15H19NO3 |
| Molecular Weight | 261.1365 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.1365 Da |
| Heavy Atoms | 19 |
| Complexity | 336.0 |
| SMILES | CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2CCCCC2 |
| InChIKey | VQFXIAJCTPJXHT-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid
Property Insights of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid
The XLogP value of 3.1 indicates that 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid. Following Lipinski's Rule of Five, 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid has 2 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 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid?
The CAS number of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid is 890981-42-7.
What is the molecular formula of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid?
The molecular formula of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid is C15H19NO3.
What is the molecular weight of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid?
The molecular weight of 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid is 261.1365 g/mol.
Where can I buy 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid?
You can request a quote for 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid?
Yes, CoreyChem provides custom synthesis services for 3-[(Cyclohexylcarbonyl)amino]-4-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.