TL;DR: gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine (CAS 152684-55-4) is a chemical compound with molecular formula C23H26ClN3O6S and molecular weight 507.12308 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-5-[[(2R)-2-amino-3-[(4-chlorophenyl)methylsulfanyl]propanoyl]-[(R)-carboxy(phenyl)methyl]amino]-5-oxopentanoic acid
Also Known As: Ggcbcp, gamma-Gln-S-(pclbz)cys-phgly, gamma-Glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine, N-(S-((4-Chlorophenyl)methyl)-N-L-gamma-glutamyl-L-cysteinyl)-D-2-phenylglycine, Glycine, N-(S-((4-chlorophenyl)methyl)-N-L-gamma-glutamyl-L-cysteinyl)-D-2-phenyl-
| Molecular Formula | C23H26ClN3O6S |
| Molecular Weight | 507.12308 g/mol |
| XLogP | -2.9 |
| Topological Polar Surface Area (TPSA) | 189.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 507.12308 Da |
| Heavy Atoms | 34 |
| Complexity | 713.0 |
| SMILES | C1=CC=C(C=C1)[C@H](C(=O)O)N(C(=O)CC[C@@H](C(=O)O)N)C(=O)[C@H](CSCC2=CC=C(C=C2)Cl)N |
| InChIKey | YUENTQVIQRRGQD-CMKODMSKSA-N |
The XLogP value of -2.9 indicates that gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 189.0 Ų indicates high polarity, suggesting gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine is 152684-55-4.
The molecular formula of gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine is C23H26ClN3O6S.
The molecular weight of gamma-glutaminyl-S-(4-chlorobenzyl)cysteinyl-phenylglycine is 507.12308 g/mol.
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