GF 94
TL;DR: GF 94 (CAS 80658-46-4) is a chemical compound with molecular formula C53H76N14O13 and molecular weight 1116.57 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[(2S)-1-[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]-2,5-dihydropyrrole-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Also Known As: GF 94, (2S)-1-[(2S)-1-[(2S,3S)-2-[[(2S)-5-Amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]-2,5-dihydropyrrole-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid, ((S)-1-(L-glutamyl-L-tryptophyl)-2,5-dihydro-1H-pyrrole-2-carbonyl)-L-arginyl-L-prolyl-L-glutaminyl-L-isoleucyl-L-prolyl-L-proline, L-Proline, 1-(1-(N-(N2-(1-(N2-(3,4-didehydro-1-(N-L-alpha-glutamyl-L-tryptophyl)-L-prolyl)-L-arginyl)-L-prolyl)-L-glutaminyl)-L-isoleucyl)-L-prolyl)-, (2S)-1-[(2S)-1-[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-5-hydroxy-5-oxopentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]-2,5-dihydropyrrole-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
| Molecular Formula | C53H76N14O13 |
|---|---|
| Molecular Weight | 1116.57 g/mol |
| LogP | -3.7 |
| Topological Polar Surface Area | 422.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 27 |
| Exact Mass | 1116.5717 |
| Heavy Atoms | 80 |
| Complexity | 2370.0 |
Chemical Identifiers
| CAS Number | 80658-46-4 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]4C=CCN4C(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CCC(=O)O)N |
| InChIKey | GQRQBTVVQACSCK-AXPLDACSSA-N |
Product Overview
GF 94 (CAS 80658-46-4), with molecular formula C53H76N14O13 and molecular weight 1116.57 g/mol. IUPAC: (2S)-1-[(2S)-1-[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]-2,5-dihydropyrrole-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of GF 94
Property Insights of GF 94
The XLogP value of -3.7 indicates that GF 94 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 422.0 Ų indicates high polarity, suggesting GF 94 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GF 94 has 11 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of GF 94?
The CAS number of GF 94 is 80658-46-4.
What is the molecular formula of GF 94?
The molecular formula of GF 94 is C53H76N14O13.
What is the molecular weight of GF 94?
The molecular weight of GF 94 is 1116.57 g/mol.
Where can I buy GF 94?
You can request a quote for GF 94 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GF 94?
Yes, KEHONG BIO provides custom synthesis services for GF 94 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.