Nta 208
TL;DR: Nta 208 (CAS 32527-53-0) is a chemical compound with molecular formula C16H21Cl2N3O3S and molecular weight 405.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-[2-[4-(2-hydroxypropyl)piperazin-4-ium-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one chloride
Also Known As: NTA 208, 5-Chloro-3-(4-(2-hydroxy-2-methylethyl)piperazin-1-yl)carbonylmethyl-2-benzothiazolinone HCl, 2-Benzothiazolinone, 5-chloro-3-(4-((2-hydroxy-2-methyl)ethyl)piperazin-1-yl)carbonylmethyl-, hydrochloride, 2-Benzothiazolinone, 5-chloro-3-(4-((2-hydroxy-2-methyl)ethyl)piperazin-1-yl)carbonylmethyl-,hydrochloride, 1-Piperazineethanol, 4-[(5-chloro-2-oxo-3(2H)-benzothiazolyl)acetyl]-.alpha.-methyl-
| Molecular Formula | C16H21Cl2N3O3S |
|---|---|
| Molecular Weight | 405.07 g/mol |
| LogP | -3.17 |
| Topological Polar Surface Area | 90.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.06805 |
| Heavy Atoms | 25 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 32527-53-0 |
|---|---|
| SMILES | CC(C[NH+]1CCN(CC1)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O)O.[Cl-] |
| InChIKey | SWMPOMJQLSHCRO-UHFFFAOYSA-N |
Product Overview
Nta 208 (CAS 32527-53-0), with molecular formula C16H21Cl2N3O3S and molecular weight 405.07 g/mol. IUPAC: 5-chloro-3-[2-[4-(2-hydroxypropyl)piperazin-4-ium-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one chloride.
Chemical Property Profile of Nta 208
Property Insights of Nta 208
The XLogP value of -3.17 indicates that Nta 208 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Nta 208. Following Lipinski's Rule of Five, Nta 208 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 Nta 208?
The CAS number of Nta 208 is 32527-53-0.
What is the molecular formula of Nta 208?
The molecular formula of Nta 208 is C16H21Cl2N3O3S.
What is the molecular weight of Nta 208?
The molecular weight of Nta 208 is 405.07 g/mol.
Where can I buy Nta 208?
You can request a quote for Nta 208 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nta 208?
Yes, KEHONG BIO provides custom synthesis services for Nta 208 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.