TL;DR: Homocysteine, S-(1,2-dichloroethenyl)-N-methyl- (CAS 106343-14-0) is a chemical compound with molecular formula C7H11Cl2NO2S and molecular weight 242.98875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-[(Z)-1,2-dichloroethenyl]sulfanyl-2-(methylamino)butanoic acid
Also Known As: Homocysteine, S-(1,2-dichloroethenyl)-N-methyl-, (2S)-4-[(Z)-1,2-dichloroethenyl]sulfanyl-2-(methylamino)butanoic acid, (2S)-4-[(Z)-1,2-dichloroethenyl]sulfanyl-2-methylamino-butanoic Acid
| Molecular Formula | C7H11Cl2NO2S |
| Molecular Weight | 242.98875 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 242.98875 Da |
| Heavy Atoms | 13 |
| Complexity | 199.0 |
| SMILES | CN[C@@H](CCS/C(=C/Cl)/Cl)C(=O)O |
| InChIKey | WPIBFKJCNXUXAX-WHEKYOLUSA-N |
The XLogP value of -0.2 indicates that Homocysteine, S-(1,2-dichloroethenyl)-N-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Homocysteine, S-(1,2-dichloroethenyl)-N-methyl-. Following Lipinski's Rule of Five, Homocysteine, S-(1,2-dichloroethenyl)-N-methyl- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Homocysteine, S-(1,2-dichloroethenyl)-N-methyl- is 106343-14-0.
The molecular formula of Homocysteine, S-(1,2-dichloroethenyl)-N-methyl- is C7H11Cl2NO2S.
The molecular weight of Homocysteine, S-(1,2-dichloroethenyl)-N-methyl- is 242.98875 g/mol.
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