RefChem:332563
TL;DR: RefChem:332563 (CAS 63982-39-8) is a chemical compound with molecular formula C12H19ClN2O2 and molecular weight 258.1135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[1-[4-(methylcarbamoyloxy)phenyl]ethyl]azanium chloride
Also Known As: T-1844, Carbamic acid, methyl-, alpha-dimethylamino-alpha-methyl-p-tolyl ester, hydrochloride, Carbamic acid, methyl-, 4-(1-(dimethylamino)ethyl)phenyl ester, hydrochloride, dimethyl-[1-[4-(methylcarbamoyloxy)phenyl]ethyl]azanium chloride, 7-oxobicyclo[4.2.0]octa-1(6),2,4-triene-4-sulfonyl chloride
Technical Specifications
| Molecular Formula | C12H19ClN2O2 |
| Molecular Weight | 258.1135 g/mol |
| XLogP | -2.39 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.1135 Da |
| Heavy Atoms | 17 |
| Complexity | 223.0 |
| SMILES | CC(C1=CC=C(C=C1)OC(=O)NC)[NH+](C)C.[Cl-] |
| InChIKey | LTWWGJIGDHZPEW-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:332563
Property Insights of RefChem:332563
The XLogP value of -2.39 indicates that RefChem:332563 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, RefChem:332563 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:332563 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:332563?
The CAS number of RefChem:332563 is 63982-39-8.
What is the molecular formula of RefChem:332563?
The molecular formula of RefChem:332563 is C12H19ClN2O2.
What is the molecular weight of RefChem:332563?
The molecular weight of RefChem:332563 is 258.1135 g/mol.
Where can I buy RefChem:332563?
You can request a quote for RefChem:332563 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:332563?
Yes, CoreyChem provides custom synthesis services for RefChem:332563 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.