GR 94800
TL;DR: GR 94800 (CAS 141636-65-9) is a chemical compound with molecular formula C49H61N9O8 and molecular weight 903.4643 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-[(2S)-1-amino-1-oxohexan-2-yl]-1-[(2R)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-benzamidopropanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
Also Known As: GR 94800, GR 94800 TFA, Nalpha-Benzoyl-ala-ala-D-trp-phe-D-pro-pro-nle-NH2, Bz-Ala-Ala-D-Trp-Phe-D-Pro-Pro-Nle-NH2, N-alpha-benzoyl-Ala-Ala-D-Trp-Phe-D-Pro-Pro-Nle-NH2
Technical Specifications
| Molecular Formula | C49H61N9O8 |
| Molecular Weight | 903.4643 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 245.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 903.4643 Da |
| Heavy Atoms | 66 |
| Complexity | 1720.0 |
| SMILES | CCCC[C@@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H]2CCCN2C(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C6=CC=CC=C6 |
| InChIKey | CWEISCOCKRHHOU-UJYVDGJVSA-N |
Chemical Property Profile of GR 94800
Property Insights of GR 94800
The XLogP value of 4.4 indicates that GR 94800 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 245.0 Ų indicates high polarity, suggesting GR 94800 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GR 94800 has 7 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 GR 94800?
The CAS number of GR 94800 is 141636-65-9.
What is the molecular formula of GR 94800?
The molecular formula of GR 94800 is C49H61N9O8.
What is the molecular weight of GR 94800?
The molecular weight of GR 94800 is 903.4643 g/mol.
Where can I buy GR 94800?
You can request a quote for GR 94800 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for GR 94800?
Yes, CoreyChem provides custom synthesis services for GR 94800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.