Purealidine B
TL;DR: Purealidine B (CAS 138590-55-3) is a chemical compound with molecular formula C24H30Br4N3O5+ and molecular weight 755.8919 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3,5-dibromo-4-[3-[[(6S)-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carbonyl]amino]propoxy]phenyl]ethyl-trimethylazanium
Also Known As: PUREALIDINE B, 2-[3,5-Dibromo-4-(3-{[(7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-trien-3-yl)(hydroxy)methylidene]amino}propoxy)phenyl]-N,N,N-trimethylethan-1-aminium, 2-[3,5-dibromo-4-[3-[[(10S)-7,9-dibromo-10-hydroxy-8-methoxy-4-oxa-3-azaspiro[4.5]deca-2,6,8-triene-2-carbonyl]amino]propoxy]phenyl]ethyl-trimethylazanium, 2-{3,5-Dibromo-4-[3-({[(10S)-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-trien-3-yl](hydroxy)methylidene}amino)propoxy]phenyl}-N,N,N-trimethylethan-1-aminium
Technical Specifications
| Molecular Formula | C24H30Br4N3O5+ |
| Molecular Weight | 755.8919 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 89.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 755.8919 Da |
| Heavy Atoms | 36 |
| Complexity | 895.0 |
| SMILES | C[N+](C)(C)CCC1=CC(=C(C(=C1)Br)OCCCNC(=O)C2=NOC3(C2)C=C(C(=C([C@H]3O)Br)OC)Br)Br |
| InChIKey | VEDYDCILGPEVAY-LETIRJCYSA-O |
Chemical Property Profile of Purealidine B
Property Insights of Purealidine B
The XLogP value of 4.0 indicates that Purealidine B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Purealidine B. Following Lipinski's Rule of Five, Purealidine B has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Purealidine B?
The CAS number of Purealidine B is 138590-55-3.
What is the molecular formula of Purealidine B?
The molecular formula of Purealidine B is C24H30Br4N3O5+.
What is the molecular weight of Purealidine B?
The molecular weight of Purealidine B is 755.8919 g/mol.
Where can I buy Purealidine B?
You can request a quote for Purealidine B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Purealidine B?
Yes, CoreyChem provides custom synthesis services for Purealidine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.