Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-
TL;DR: Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- (CAS 105397-87-3) is a chemical compound with molecular formula C10H8N2O3S and molecular weight 236.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-ylamino)-3-oxopropanoic acid
Also Known As: Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-, 2-(benzothiazol-2-ylcarbamoyl)acetic Acid, 3-(1,3-benzothiazol-2-ylamino)-3-oxopropanoic acid, 3-[(1,3-Benzothiazol-2-yl)amino]-3-oxopropanoic acid
| Molecular Formula | C10H8N2O3S |
|---|---|
| Molecular Weight | 236.03 g/mol |
| LogP | 1.7095 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.02556 |
| Heavy Atoms | 16 |
| Complexity | 516.7427 |
Chemical Identifiers
| CAS Number | 105397-87-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)CC(=O)O |
Product Overview
Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- (CAS 105397-87-3), with molecular formula C10H8N2O3S and molecular weight 236.03 g/mol. IUPAC: 3-(1,3-benzothiazol-2-ylamino)-3-oxopropanoic acid.
Chemical Property Profile of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-
Property Insights of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-
The XLogP value of 1.7095 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-. Following Lipinski's Rule of Five, Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- 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 Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-?
The CAS number of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- is 105397-87-3.
What is the molecular formula of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-?
The molecular formula of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- is C10H8N2O3S.
What is the molecular weight of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-?
The molecular weight of Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- is 236.03 g/mol.
Where can I buy Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-?
You can request a quote for Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 3-(2-benzothiazolylamino)-3-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.