5-苯并噻唑乙酸2-(2-羟基苯基)
TL;DR: 5-苯并噻唑乙酸2-(2-羟基苯基) (CAS 36774-70-6) is a chemical compound with molecular formula C15H11NO3S and molecular weight 285.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-苯并噻唑乙酸2-(2-羟基苯基)
2-[2-(2-hydroxyphenyl)-1,3-benzothiazol-5-yl]acetic acid
Also Known As: phenyl naphthoate, 2-(2-Hydroxyphenyl)-5-benzothiazoleacetic acid, 5-BENZOTHIAZOLEACETIC ACID, 2-(2-HYDROXYPHENYL)-, 2-[2-(2-hydroxyphenyl)-1,3-benzothiazol-5-yl]acetic acid, 2-[(2Z)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-3H-1,3-benzothiazol-5-yl]acetic acid
| Molecular Formula | C15H11NO3S |
|---|---|
| Molecular Weight | 285.05 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.04596 |
| Heavy Atoms | 20 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 36774-70-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC3=C(S2)C=CC(=C3)CC(=O)O)O |
| InChIKey | DBDGIESKIDQGRA-UHFFFAOYSA-N |
Product Overview
5-苯并噻唑乙酸2-(2-羟基苯基) (CAS 36774-70-6), with molecular formula C15H11NO3S and molecular weight 285.05 g/mol. IUPAC: 2-[2-(2-hydroxyphenyl)-1,3-benzothiazol-5-yl]acetic acid.
Chemical Property Profile of 5-苯并噻唑乙酸2-(2-羟基苯基)
Property Insights of 5-苯并噻唑乙酸2-(2-羟基苯基)
The XLogP value of 3.1 indicates that 5-苯并噻唑乙酸2-(2-羟基苯基) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-苯并噻唑乙酸2-(2-羟基苯基). Following Lipinski's Rule of Five, 5-苯并噻唑乙酸2-(2-羟基苯基) has 2 hydrogen bond donor(s) and 5 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 5-苯并噻唑乙酸2-(2-羟基苯基)?
The CAS number of 5-苯并噻唑乙酸2-(2-羟基苯基) is 36774-70-6.
What is the molecular formula of 5-苯并噻唑乙酸2-(2-羟基苯基)?
The molecular formula of 5-苯并噻唑乙酸2-(2-羟基苯基) is C15H11NO3S.
What is the molecular weight of 5-苯并噻唑乙酸2-(2-羟基苯基)?
The molecular weight of 5-苯并噻唑乙酸2-(2-羟基苯基) is 285.05 g/mol.
Where can I buy 5-苯并噻唑乙酸2-(2-羟基苯基)?
You can request a quote for 5-苯并噻唑乙酸2-(2-羟基苯基) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-苯并噻唑乙酸2-(2-羟基苯基)?
Yes, KEHONG BIO provides custom synthesis services for 5-苯并噻唑乙酸2-(2-羟基苯基) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.