RefChem:1063707
TL;DR: RefChem:1063707 (CAS 101912-00-9) is a chemical compound with molecular formula C19H24ClNO4S and molecular weight 397.11145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-methyl-3-morpholin-4-ium-4-yl-1-thiophen-2-ylpropyl) phenyl carbonate chloride
Also Known As: Carbonic acid, (alpha-(1-(morpholinomethyl)ethyl)-2-thenyl) phenyl ester, hydrochloride, (alpha-(1-(Morpholinomethyl)ethyl)-2-thenyl) phenyl carbonate hydrochloride, (2-methyl-3-morpholin-4-ium-4-yl-1-thiophen-2-ylpropyl) phenyl carbonate chloride, 4-{2-methyl-3-[(phenoxycarbonyl)oxy]-3-(thiophen-2-yl)propyl}morpholin-4-ium chloride, 2-Methyl-3-(morpholin-4-yl)-1-(thiophen-2-yl)propyl phenyl carbonate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C19H24ClNO4S |
| Molecular Weight | 397.11145 g/mol |
| XLogP | -0.44 |
| Topological Polar Surface Area (TPSA) | 77.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.11145 Da |
| Heavy Atoms | 26 |
| Complexity | 410.0 |
| SMILES | CC(C[NH+]1CCOCC1)C(C2=CC=CS2)OC(=O)OC3=CC=CC=C3.[Cl-] |
| InChIKey | UNDZTOBENXRDJU-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1063707
Property Insights of RefChem:1063707
The XLogP value of -0.44 indicates that RefChem:1063707 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1063707. Following Lipinski's Rule of Five, RefChem:1063707 has 1 hydrogen bond donor(s) and 6 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:1063707?
The CAS number of RefChem:1063707 is 101912-00-9.
What is the molecular formula of RefChem:1063707?
The molecular formula of RefChem:1063707 is C19H24ClNO4S.
What is the molecular weight of RefChem:1063707?
The molecular weight of RefChem:1063707 is 397.11145 g/mol.
Where can I buy RefChem:1063707?
You can request a quote for RefChem:1063707 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1063707?
Yes, CoreyChem provides custom synthesis services for RefChem:1063707 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.