GR 100679
TL;DR: GR 100679 (CAS 150351-87-4) is a chemical compound with molecular formula C34H44N6O5 and molecular weight 616.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[[(2S)-1-[[(2R)-1-[[(2S)-1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]cyclohexanecarboxamide
Also Known As: GR 100679, J2.411.497J, N-(Cyclohexylcarbonyl)-Gly-L-Ala-D-Trp-L-Phe-N,N-dimethyl-NH2, N-(Cyclohexylcarbonyl)glycyl-L-alanyl-D-tryptophyl-N,N-dimethyl-L-phenylalaninamide, (2S)-2-[(2R)-2-[(2S)-2-[2-(cyclohexylformamido)acetamido]propanamido]-3-(1H-indol-3-yl)propanamido]-N,N-dimethyl-3-phenylpropanamide
| Molecular Formula | C34H44N6O5 |
|---|---|
| Molecular Weight | 616.34 g/mol |
| LogP | 2.2121 |
| Topological Polar Surface Area | 152.5 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 616.33734 |
| Heavy Atoms | 45 |
| Complexity | 1480.4797 |
Chemical Identifiers
| CAS Number | 150351-87-4 |
|---|---|
| SMILES | C[C@@H](C(=O)N[C@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N(C)C)NC(=O)CNC(=O)C4CCCCC4 |
Product Overview
GR 100679 (CAS 150351-87-4), with molecular formula C34H44N6O5 and molecular weight 616.34 g/mol. IUPAC: N-[2-[[(2S)-1-[[(2R)-1-[[(2S)-1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]cyclohexanecarboxamide.
Chemical Property Profile of GR 100679
Property Insights of GR 100679
The XLogP value of 2.2121 suggests moderate lipophilicity, balancing water solubility and membrane permeability for GR 100679. The TPSA of 152.5 Ų indicates high polarity, suggesting GR 100679 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GR 100679 has 5 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of GR 100679?
The CAS number of GR 100679 is 150351-87-4.
What is the molecular formula of GR 100679?
The molecular formula of GR 100679 is C34H44N6O5.
What is the molecular weight of GR 100679?
The molecular weight of GR 100679 is 616.34 g/mol.
Where can I buy GR 100679?
You can request a quote for GR 100679 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GR 100679?
Yes, KEHONG BIO provides custom synthesis services for GR 100679 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.