2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride
TL;DR: 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride (CAS 14627-26-0) is a chemical compound with molecular formula C14H18Cl2N2O2 and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-(2-piperidin-1-ium-1-ylethyl)-1,3-benzoxazol-2-one chloride
Also Known As: 6-Chloro-3-(2-piperidinoethyl)-2-benzoxazolinone hydrochloride, 2-BENZOXAZOLINONE, 6-CHLORO-3-(2-PIPERIDINOETHYL)-, MONOHYDROCHLORIDE, 6-chloro-3-(2-piperidin-1-ium-1-ylethyl)-1,3-benzoxazol-2-one chloride, RefChem:256441
| Molecular Formula | C14H18Cl2N2O2 |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | -1.68 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.07452 |
| Heavy Atoms | 20 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 14627-26-0 |
|---|---|
| SMILES | C1CC[NH+](CC1)CCN2C3=C(C=C(C=C3)Cl)OC2=O.[Cl-] |
| InChIKey | QTAFGPYMJYRBCR-UHFFFAOYSA-N |
Product Overview
2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride (CAS 14627-26-0), with molecular formula C14H18Cl2N2O2 and molecular weight 316.07 g/mol. IUPAC: 6-chloro-3-(2-piperidin-1-ium-1-ylethyl)-1,3-benzoxazol-2-one chloride.
Chemical Property Profile of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride
Property Insights of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride
The XLogP value of -1.68 indicates that 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.0 Ų, 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride has 1 hydrogen bond donor(s) and 3 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 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride?
The CAS number of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride is 14627-26-0.
What is the molecular formula of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride?
The molecular formula of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride is C14H18Cl2N2O2.
What is the molecular weight of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride?
The molecular weight of 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride is 316.07 g/mol.
Where can I buy 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride?
You can request a quote for 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoxazolinone, 6-chloro-3-(2-piperidinoethyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.