TL;DR: Awl 60 (CAS 140716-14-9) is a chemical compound with molecular formula C57H65N9O8S and molecular weight 1035.4677 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2R)-1-[[(2S)-1-[[(2R)-1-[[(2R)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide
Also Known As: Awl 60, Tyr-pro-D-phe-phe-D-phe-D-trp-metnh2, Tyrosyl-prolyl-phenylalanyl-phenylalanyl-phenylalanyl-tryptophyl-methioninamide, (2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2R)-1-[[(2S)-1-[[(2R)-1-[[(2R)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide, L-Methioninamide, L-tyrosyl-L-prolyl-D-phenylalanyl-L-phenylalanyl-D-phenylalanyl-D-tryptophyl-
| Molecular Formula | C57H65N9O8S |
| Molecular Weight | 1035.4677 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 296.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 25 |
| Exact Mass | 1035.4677 Da |
| Heavy Atoms | 75 |
| Complexity | 1870.0 |
| SMILES | CSCC[C@@H](C(=O)N)NC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@@H](CC5=CC=CC=C5)NC(=O)[C@@H]6CCCN6C(=O)[C@H](CC7=CC=C(C=C7)O)N |
| InChIKey | VOMQYBALZJIZLK-URSBCDAASA-N |
The XLogP value of 5.4 indicates that Awl 60 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 296.0 Ų indicates high polarity, suggesting Awl 60 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Awl 60 has 9 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Awl 60 is 140716-14-9.
The molecular formula of Awl 60 is C57H65N9O8S.
The molecular weight of Awl 60 is 1035.4677 g/mol.
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