![3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid structure](/static/products/3453/345347-88-8.webp)
3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid
TL;DR: 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid (CAS 345347-88-8) is a chemical compound with molecular formula C16H16N2O3S and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-ylcarbamoyl)bicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: BIM-0046775.P001, 3-[(1,3-benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid, 3-(1,3-benzothiazol-2-ylcarbamoyl)bicyclo[2.2.1]heptane-2-carboxylic acid, bicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(2-benzothiazolylamino)carbonyl]-, 2-(1,3-benzothiazol-2-ylcarbamoyl)bicyclo[2.2.1]heptane-3-carboxylic acid
| Molecular Formula | C16H16N2O3S |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 2.9817 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.08817 |
| Heavy Atoms | 22 |
| Complexity | 723.6838 |
Chemical Identifiers
| CAS Number | 345347-88-8 |
|---|---|
| SMILES | C1CC2CC1C(C2C(=O)O)C(=O)NC3=NC4=CC=CC=C4S3 |
Product Overview
3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid (CAS 345347-88-8), with molecular formula C16H16N2O3S and molecular weight 316.09 g/mol. IUPAC: 3-(1,3-benzothiazol-2-ylcarbamoyl)bicyclo[2.2.1]heptane-2-carboxylic acid.
Chemical Property Profile of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid
Property Insights of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid
The XLogP value of 2.9817 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid. Following Lipinski's Rule of Five, 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid 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-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid?
The CAS number of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid is 345347-88-8.
What is the molecular formula of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid?
The molecular formula of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid is C16H16N2O3S.
What is the molecular weight of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid?
The molecular weight of 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid is 316.09 g/mol.
Where can I buy 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid?
You can request a quote for 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(1,3-Benzothiazol-2-ylamino)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.