6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride
TL;DR: 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride (CAS 122956-67-6) is a chemical compound with molecular formula C15H19ClN2O3 and molecular weight 310.10843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid;hydrate;hydrochloride
Also Known As: 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride, 2-Naphthalenecarboxylic acid, 5,6,7,8- tetrahydro-6-(1H-imidazol-1-ylmethyl)-, hydrochloride, hydrate(1:1:1), 2-Naphthalenecarboxylicacid, 5,6,7,8-tetrahydro-6-(1H-imidazol-1-ylmethyl)-, hydrochloride, hydrate(1:1:1), 2-Naphthalenecarboxylic acid, 5,6,7,8-tetrahydro-6-(1H-imidazol-1-ylmethyl)-, hydrochloride, hydrate(1:1:1), 6-(1H-imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid hydrochloride hydrate
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H19ClN2O3 |
| Molecular Weight | 310.10843 g/mol |
| XLogP | 1.9835 |
| Topological Polar Surface Area (TPSA) | 56.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.10843 Da |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
| SMILES | C1CC2=C(CC1CN3C=CN=C3)C=CC(=C2)C(=O)O.O.Cl |
| InChIKey | HROAUOQMZRCAEF-UHFFFAOYSA-N |
Chemical Property Profile of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride
Property Insights of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride
The XLogP value of 1.9835 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride. With a topological polar surface area (TPSA) of 56.1 Ų, 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride?
The CAS number of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride is 122956-67-6.
What is the molecular formula of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride?
The molecular formula of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride is C15H19ClN2O3.
What is the molecular weight of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride?
The molecular weight of 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride is 310.10843 g/mol.
Where can I buy 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride?
You can request a quote for 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride?
Yes, CoreyChem provides custom synthesis services for 6-(imidazol-1-ylmethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic Acid Hydrate Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.