TL;DR: Arginine-glycine-aspartate-O-methyltyrosine amide (CAS 123491-58-7) is a chemical compound with molecular formula C22H34N8O7 and molecular weight 522.25507 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-[[(2S)-2-amino-3-(4-methoxyphenyl)propanoyl]amino]-4-oxobutanoic acid
Also Known As: RGDY, Arg-gly-asp-O-methyl-tyr-NH2, Arginine-glycine-aspartate-O-methyltyrosine amide, SC 46749, L-Tyrosinamide, L-arginylglycyl-L-alpha-aspartyl-O-methyl-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H34N8O7 |
| Molecular Weight | 522.25507 g/mol |
| XLogP | -5.4 |
| Topological Polar Surface Area (TPSA) | 267.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 522.25507 Da |
| Heavy Atoms | 37 |
| Complexity | 826.0 |
| SMILES | COC1=CC=C(C=C1)C[C@@H](C(=O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)N)N |
| InChIKey | YAYLYOCENKWKIB-JYJNAYRXSA-N |
The XLogP value of -5.4 indicates that Arginine-glycine-aspartate-O-methyltyrosine amide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 267.0 Ų indicates high polarity, suggesting Arginine-glycine-aspartate-O-methyltyrosine amide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Arginine-glycine-aspartate-O-methyltyrosine amide has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Arginine-glycine-aspartate-O-methyltyrosine amide is 123491-58-7.
The molecular formula of Arginine-glycine-aspartate-O-methyltyrosine amide is C22H34N8O7.
The molecular weight of Arginine-glycine-aspartate-O-methyltyrosine amide is 522.25507 g/mol.
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