GR 70982
TL;DR: GR 70982 (CAS 124646-43-1) is a chemical compound with molecular formula C42H62N8O6 and molecular weight 774.47925 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(2S)-1-[[(2S)-2-[[(2S,3S,5R)-6-(4-aminobutylamino)-1-cyclohexyl-3-hydroxy-6-oxo-5-(pyridin-4-ylmethyl)hexan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Also Known As: GR 70982, N-(5-((4-Aminobutyl)amino)-2-hydroxy-5-oxo-1-(cyclohexylmethyl)-4-(4-pyridinylmethyl)-1-pentyl)-N-((1,1-dimethylethoxy)carbonyl)phenylalanyl-L-histidinamide, tert-butyl N-[(2S)-1-[[(2S)-2-[[(2S,3S,5R)-6-(4-aminobutylamino)-1-cyclohexyl-3-hydroxy-6-oxo-5-(pyridin-4-ylmethyl)hexan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate, Nalpha-{(2S,3S,5R)-6-[(4-Aminobutyl)amino]-1-cyclohexyl-3-hydroxy-6-oxo-5-[(pyridin-4-yl)methyl]hexan-2-yl}-N-{(2S)-2-[(tert-butoxycarbonyl)amino]-3-phenylpropanoyl}-L-histidinamide
Technical Specifications
| Molecular Formula | C42H62N8O6 |
| Molecular Weight | 774.47925 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 213.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Exact Mass | 774.47925 Da |
| Heavy Atoms | 56 |
| Complexity | 1180.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)[C@H](CC2=CN=CN2)N[C@@H](CC3CCCCC3)[C@H](C[C@@H](CC4=CC=NC=C4)C(=O)NCCCCN)O |
| InChIKey | CIGXEVSGKAVGFH-LEBFSMOPSA-N |
Chemical Property Profile of GR 70982
Property Insights of GR 70982
The XLogP value of 4.7 indicates that GR 70982 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 213.0 Ų indicates high polarity, suggesting GR 70982 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GR 70982 has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of GR 70982?
The CAS number of GR 70982 is 124646-43-1.
What is the molecular formula of GR 70982?
The molecular formula of GR 70982 is C42H62N8O6.
What is the molecular weight of GR 70982?
The molecular weight of GR 70982 is 774.47925 g/mol.
Where can I buy GR 70982?
You can request a quote for GR 70982 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for GR 70982?
Yes, CoreyChem provides custom synthesis services for GR 70982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.