jasplakinolide
TL;DR: jasplakinolide (CAS 102396-24-7) is a chemical compound with molecular formula C36H45BrN4O6 and molecular weight 708.25226 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[(2-bromo-1H-indol-3-yl)methyl]-4-(4-hydroxyphenyl)-8,10,13,15,17,19-hexamethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetrone
Also Known As: jasplakinolide, Jaspamide, NCI60_004884, 7-[(2-bromo-1H-indol-3-yl)methyl]-4-(4-hydroxyphenyl)-8,10,13,15,17,19-hexamethyl-1-oxa-5,8,11-triazacyclononadec-15-ene-2,6,9,12-tetrone, (3S,6R,9R,13S,15R,16E,19S)-3,5,13,15,17,19-Hexamethyl-6-[(2-bromo-1H-indole-3-yl)methyl]-9-(4-hydroxyphenyl)-12-oxa-2,5,8-triazacyclononadeca-16-ene-1,4,7,11-tetraone
Technical Specifications
| Molecular Formula | C36H45BrN4O6 |
| Molecular Weight | 708.25226 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 708.25226 Da |
| Heavy Atoms | 47 |
| Complexity | 1140.0 |
| SMILES | CC1CC(OC(=O)CC(NC(=O)C(N(C(=O)C(NC(=O)C(CC(=C1)C)C)C)C)CC2=C(NC3=CC=CC=C32)Br)C4=CC=C(C=C4)O)C |
| InChIKey | GQWYWHOHRVVHAP-UHFFFAOYSA-N |
Chemical Property Profile of jasplakinolide
Property Insights of jasplakinolide
The XLogP value of 5.6 indicates that jasplakinolide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting jasplakinolide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, jasplakinolide has 4 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 jasplakinolide?
The CAS number of jasplakinolide is 102396-24-7.
What is the molecular formula of jasplakinolide?
The molecular formula of jasplakinolide is C36H45BrN4O6.
What is the molecular weight of jasplakinolide?
The molecular weight of jasplakinolide is 708.25226 g/mol.
Where can I buy jasplakinolide?
You can request a quote for jasplakinolide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for jasplakinolide?
Yes, CoreyChem provides custom synthesis services for jasplakinolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.