TL;DR: 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide (CAS 141208-32-4) is a chemical compound with molecular formula C12H14Cl2N2O2 and molecular weight 288.04324 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-[[3-[[(2-chloroacetyl)amino]methyl]phenyl]methyl]acetamide
Also Known As: 1,3-Bis(chloroacetylaminomethyl)benzene, J2.348.373D, 2,2'-dichloro-N,N'-meta-phenylenedimethylene bisacetamide, 2-chloro-N-[[3-[[(2-chloroacetyl)amino]methyl]phenyl]methyl]acetamide, 2,2'-Dichloro-N,N'-[1,3-phenylenebis(methylene)]diacetamide
| Molecular Formula | C12H14Cl2N2O2 |
| Molecular Weight | 288.04324 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 288.04324 Da |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
| SMILES | C1=CC(=CC(=C1)CNC(=O)CCl)CNC(=O)CCl |
| InChIKey | MCNVCFIEUGPUIL-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide. With a topological polar surface area (TPSA) of 58.2 Ų, 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide is 141208-32-4.
The molecular formula of 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide is C12H14Cl2N2O2.
The molecular weight of 2-chloro-N-({3-[(2-chloroacetylamino)methyl]phenyl}methyl)acetamide is 288.04324 g/mol.
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