TL;DR: 2-bromo-6-cystein-S-ylhydroquinone (CAS 127399-38-6) is a chemical compound with molecular formula C9H10BrNO4S and molecular weight 306.9514 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-amino-3-(3-bromo-2,5-dihydroxyphenyl)sulfanylpropanoic acid
Also Known As: 2-Bromo-6-cystein-S-ylhydroquinone, 2-Bromo-6-(cystein-S-yl)hydroquinone, S-(3-Bromo-2,5-dihydroxyphenyl)-L-cysteine, L-Cysteine, S-(3-bromo-2,5-dihydroxyphenyl)-, (2R)-2-amino-3-(3-bromo-2,5-dihydroxyphenyl)sulfanylpropanoic acid
| Molecular Formula | C9H10BrNO4S |
| Molecular Weight | 306.9514 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.9514 Da |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
| SMILES | C1=C(C=C(C(=C1SC[C@@H](C(=O)O)N)O)Br)O |
| InChIKey | ZGGBQRJPGKLWMM-LURJTMIESA-N |
The XLogP value of -1.2 indicates that 2-bromo-6-cystein-S-ylhydroquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-6-cystein-S-ylhydroquinone. Following Lipinski's Rule of Five, 2-bromo-6-cystein-S-ylhydroquinone has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-bromo-6-cystein-S-ylhydroquinone is 127399-38-6.
The molecular formula of 2-bromo-6-cystein-S-ylhydroquinone is C9H10BrNO4S.
The molecular weight of 2-bromo-6-cystein-S-ylhydroquinone is 306.9514 g/mol.
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