U 89678
TL;DR: U 89678 (CAS 157744-31-5) is a chemical compound with molecular formula C38H54N6O2 and molecular weight 626.43085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5R,8S,10R,13S,14S,16R,17S)-17-[2-[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]acetyl]-10,13,16-trimethyl-4,5,6,7,8,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: U 89678, U-89678, (5R,8S,10R,13S,14S,16R,17S)-17-[2-[2-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]acetyl]-10,13,16-trimethyl-4,5,6,7,8,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one, 21-{2-[2,6-Di(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}-16-methylpregna-1,9(11)-diene-3,20-dione, 21-{2-[2,6-Di(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}-16alpha-methyl-5beta-pregna-1,9(11)-diene-3,20-dione
Technical Specifications
| Molecular Formula | C38H54N6O2 |
| Molecular Weight | 626.43085 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 626.43085 Da |
| Heavy Atoms | 46 |
| Complexity | 1240.0 |
| SMILES | C[C@@H]1C[C@H]2[C@@H]3CC[C@@H]4CC(=O)C=C[C@@]4(C3=CC[C@@]2([C@H]1C(=O)CN5CCNCC5C6=CC(=NC(=N6)N7CCCC7)N8CCCC8)C)C |
| InChIKey | XJKDZKQCLJIYNZ-UVBXRMJNSA-N |
Chemical Property Profile of U 89678
Property Insights of U 89678
The XLogP value of 5.3 indicates that U 89678 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for U 89678. Following Lipinski's Rule of Five, U 89678 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of U 89678?
The CAS number of U 89678 is 157744-31-5.
What is the molecular formula of U 89678?
The molecular formula of U 89678 is C38H54N6O2.
What is the molecular weight of U 89678?
The molecular weight of U 89678 is 626.43085 g/mol.
Where can I buy U 89678?
You can request a quote for U 89678 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for U 89678?
Yes, CoreyChem provides custom synthesis services for U 89678 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.