RA(sub 18)
TL;DR: RA(sub 18) (CAS 54627-07-5) is a chemical compound with molecular formula C19H23ClN2O4S2 and molecular weight 442.07877 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzoyl]oxyethyl-diethylazanium chloride
Also Known As: RA(sub 18), Benzoic acid, 4-(2,3,5,7-tetrahydro-5,7-dioxo-6H-1,4-dithiino(2,3-c)pyrrol-6-yl)-, 2-(diethylamino)ethyl ester, monohydrochloride, 2-[4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)benzoyl]oxyethyl-diethylazanium chloride, BENZOIC ACID, 4-(2,3,5,7-TETRAHYDRO-5,7-DIOXO-6H-1,4-DITHIINO(2,3-c)PYRROL-6-YL)
Technical Specifications
| Molecular Formula | C19H23ClN2O4S2 |
| Molecular Weight | 442.07877 g/mol |
| XLogP | -1.66 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 442.07877 Da |
| Heavy Atoms | 28 |
| Complexity | 597.0 |
| SMILES | CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)SCCS3.[Cl-] |
| InChIKey | MMPDRGLGZQTJMV-UHFFFAOYSA-N |
Chemical Property Profile of RA(sub 18)
Property Insights of RA(sub 18)
The XLogP value of -1.66 indicates that RA(sub 18) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RA(sub 18). Following Lipinski's Rule of Five, RA(sub 18) has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RA(sub 18)?
The CAS number of RA(sub 18) is 54627-07-5.
What is the molecular formula of RA(sub 18)?
The molecular formula of RA(sub 18) is C19H23ClN2O4S2.
What is the molecular weight of RA(sub 18)?
The molecular weight of RA(sub 18) is 442.07877 g/mol.
Where can I buy RA(sub 18)?
You can request a quote for RA(sub 18) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RA(sub 18)?
Yes, CoreyChem provides custom synthesis services for RA(sub 18) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.