RefChem:340975
TL;DR: RefChem:340975 (CAS 37971-96-3) is a chemical compound with molecular formula C27H34Cl2N2O3 and molecular weight 504.19464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-piperidin-1-ium-1-yl-1-[7-(2-piperidin-1-ium-1-ylacetyl)-9H-xanthen-2-yl]ethanone dichloride
Also Known As: C27-H32-N2-O3.2Cl-H.7/2H2-O, 1,1'-(9H-Xanthene-2,7-diyl)bis(2-piperidinoethanone) hydrochloride hydrate (2:4:7), Ethanone, 1,1'-(9H-xanthene-2,7-diyl)bis(2-piperidino-, hydrochloride, hydrate (2:4:7), 2-piperidin-1-ium-1-yl-1-[7-(2-piperidin-1-ium-1-ylacetyl)-9H-xanthen-2-yl]ethanone dichloride, NSC 288397
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C27H34Cl2N2O3 |
| Molecular Weight | 504.19464 g/mol |
| XLogP | -4.11 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 504.19464 Da |
| Heavy Atoms | 34 |
| Complexity | 601.0 |
| SMILES | C1CC[NH+](CC1)CC(=O)C2=CC3=C(C=C2)OC4=C(C3)C=C(C=C4)C(=O)C[NH+]5CCCCC5.[Cl-].[Cl-] |
| InChIKey | SFTPXMOMVLJZAF-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:340975
Property Insights of RefChem:340975
The XLogP value of -4.11 indicates that RefChem:340975 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.3 Ų, RefChem:340975 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:340975 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:340975?
The CAS number of RefChem:340975 is 37971-96-3.
What is the molecular formula of RefChem:340975?
The molecular formula of RefChem:340975 is C27H34Cl2N2O3.
What is the molecular weight of RefChem:340975?
The molecular weight of RefChem:340975 is 504.19464 g/mol.
Where can I buy RefChem:340975?
You can request a quote for RefChem:340975 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:340975?
Yes, CoreyChem provides custom synthesis services for RefChem:340975 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.