Kri 1177
TL;DR: Kri 1177 (CAS 105186-68-3) is a chemical compound with molecular formula C37H45N5O6 and molecular weight 655.337 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-hydroxy-3-[[3-(1H-imidazol-5-yl)-2-[[2-(naphthalen-1-ylmethyl)-4-oxo-4-(2-phenylethylamino)butanoyl]amino]propanoyl]amino]-5-methylhexanoate
Also Known As: Kri 1177, 10beta-Hydroxy ?4-Tibolone, Hexanoic acid, 2-hydroxy-3-((3-(1H-imidazol-4-yl)-2-((2-(1-naphthalenylmethyl)-1,4-dioxo-4-((2-phenylethyl)amino)butyl)amino)-1-oxopropyl)amino)-5-methyl-, methyl ester, methyl 2-hydroxy-3-[[3-(1H-imidazol-5-yl)-2-[[2-(naphthalen-1-ylmethyl)-4-oxo-4-(2-phenylethylamino)butanoyl]amino]propanoyl]amino]-5-methylhexanoate, Methyl 3-(N-(2-(1-naphthylmethyl)-3-(phenethylcarbamoyl)propionyl)histidyl)amino-2-hydroxy-5-methylhexanoate
Technical Specifications
| Molecular Formula | C37H45N5O6 |
| Molecular Weight | 655.337 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 18 |
| Exact Mass | 655.337 Da |
| Heavy Atoms | 48 |
| Complexity | 1040.0 |
| SMILES | CC(C)CC(C(C(=O)OC)O)NC(=O)C(CC1=CN=CN1)NC(=O)C(CC2=CC=CC3=CC=CC=C32)CC(=O)NCCC4=CC=CC=C4 |
| InChIKey | UQUFRFSCUYVXBM-UHFFFAOYSA-N |
Chemical Property Profile of Kri 1177
Property Insights of Kri 1177
The XLogP value of 4.5 indicates that Kri 1177 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.0 Ų indicates high polarity, suggesting Kri 1177 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Kri 1177 has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Kri 1177?
The CAS number of Kri 1177 is 105186-68-3.
What is the molecular formula of Kri 1177?
The molecular formula of Kri 1177 is C37H45N5O6.
What is the molecular weight of Kri 1177?
The molecular weight of Kri 1177 is 655.337 g/mol.
Where can I buy Kri 1177?
You can request a quote for Kri 1177 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Kri 1177?
Yes, CoreyChem provides custom synthesis services for Kri 1177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.