TL;DR: Cyclo-rgdphg (CAS 141261-62-3) is a chemical compound with molecular formula C20H27N7O6 and molecular weight 461.20227 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-[[2-[[(E,2S)-2-amino-5-(diaminomethylideneamino)pent-3-enoyl]amino]acetyl]amino]-4-oxo-4-[[(1S)-2-oxo-1-phenylethyl]amino]butanoic acid
Also Known As: Cyclo-rgdphg, Cyclo-arg-gly-asp-phgly, Cyclic arginyl-glycyl-aspartyl-phenylglycyl, Cyclo(L-arginylglycyl-L-alpha-aspartyl-L-2-phenylglycyl), (3S)-3-[[2-[[(E,2S)-2-amino-5-(diaminomethylideneamino)pent-3-enoyl]amino]acetyl]amino]-4-oxo-4-[[(1S)-2-oxo-1-phenylethyl]amino]butanoic acid
| Molecular Formula | C20H27N7O6 |
| Molecular Weight | 461.20227 g/mol |
| XLogP | -5.1 |
| Topological Polar Surface Area (TPSA) | 232.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 461.20227 Da |
| Heavy Atoms | 33 |
| Complexity | 760.0 |
| SMILES | C1=CC=C(C=C1)[C@@H](C=O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](/C=C/CN=C(N)N)N |
| InChIKey | XVEZVWHFWXVGBZ-WVRFHGKMSA-N |
The XLogP value of -5.1 indicates that Cyclo-rgdphg is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 232.0 Ų indicates high polarity, suggesting Cyclo-rgdphg may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclo-rgdphg has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Cyclo-rgdphg is 141261-62-3.
The molecular formula of Cyclo-rgdphg is C20H27N7O6.
The molecular weight of Cyclo-rgdphg is 461.20227 g/mol.
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