Ep 80661
TL;DR: Ep 80661 (CAS 331941-57-2) is a chemical compound with molecular formula C34H46N8O4 and molecular weight 630.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-6-amino-2-[[(2R)-2-[[(2R)-2-(4-aminobutanoylamino)-3-(2-methyl-1H-indol-3-yl)propanoyl]amino]-3-(2-methyl-1H-indol-3-yl)propanoyl]amino]hexanamide
Also Known As: Ep 80661, SID:134223802, GAB-tryptophyl(2-Me)-tryptophyl(2-Me)-lysinamide, J1.481.969J, gammaAbu-2-Methyl-D-Trp-2-methyl-D-Trp-L-Lys-NH2
| Molecular Formula | C34H46N8O4 |
|---|---|
| Molecular Weight | 630.36 g/mol |
| LogP | 1.85884 |
| Topological Polar Surface Area | 214.01 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 17 |
| Exact Mass | 630.3642 |
| Heavy Atoms | 46 |
| Complexity | 1676.1213 |
Chemical Identifiers
| CAS Number | 331941-57-2 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C[C@H](C(=O)N[C@H](CC3=C(NC4=CC=CC=C43)C)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)CCCN |
Product Overview
Ep 80661 (CAS 331941-57-2), with molecular formula C34H46N8O4 and molecular weight 630.36 g/mol. IUPAC: (2S)-6-amino-2-[[(2R)-2-[[(2R)-2-(4-aminobutanoylamino)-3-(2-methyl-1H-indol-3-yl)propanoyl]amino]-3-(2-methyl-1H-indol-3-yl)propanoyl]amino]hexanamide.
Chemical Property Profile of Ep 80661
Property Insights of Ep 80661
The XLogP value of 1.85884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ep 80661. The TPSA of 214.01 Ų indicates high polarity, suggesting Ep 80661 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ep 80661 has 8 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ep 80661?
The CAS number of Ep 80661 is 331941-57-2.
What is the molecular formula of Ep 80661?
The molecular formula of Ep 80661 is C34H46N8O4.
What is the molecular weight of Ep 80661?
The molecular weight of Ep 80661 is 630.36 g/mol.
Where can I buy Ep 80661?
You can request a quote for Ep 80661 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ep 80661?
Yes, KEHONG BIO provides custom synthesis services for Ep 80661 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.