Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-
TL;DR: Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- (CAS 127627-70-7) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,5-dihydro-1,3-thiazol-2-ylamino)-5-methylbenzoic acid
Also Known As: Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-, 2-((4,5-Dihydro-2-thiazolyl)amino)-5-methylbenzoic acid, 2-(4,5-dihydro-1,3-thiazol-2-ylamino)-5-methylbenzoic acid, 2-[(4,5-Dihydro-1,3-thiazol-2-yl)amino]-5-methylbenzoic acid, (1R,2S,3S,5S)-3-(4-Fluoro-phenyl)-8-propyl-8-aza-bicyclo[3.2.1]octane-2-carboxylic acid methyl ester
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 2.20792 |
| Topological Polar Surface Area | 61.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 457.29782 |
Chemical Identifiers
| CAS Number | 127627-70-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC2=NCCS2)C(=O)O |
Product Overview
Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- (CAS 127627-70-7), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: 2-(4,5-dihydro-1,3-thiazol-2-ylamino)-5-methylbenzoic acid.
Chemical Property Profile of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-
Property Insights of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-
The XLogP value of 2.20792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-. The TPSA of 61.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-. Following Lipinski's Rule of Five, Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- 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 Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-?
The CAS number of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- is 127627-70-7.
What is the molecular formula of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-?
The molecular formula of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- is C11H12N2O2S.
What is the molecular weight of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-?
The molecular weight of Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- is 236.06 g/mol.
Where can I buy Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-?
You can request a quote for Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((4,5-dihydro-2-thiazolyl)amino)-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.