TL;DR: [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate (CAS 145252-21-7) is a chemical compound with molecular formula C12H15ClN2O2 and molecular weight 254.0822 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate
Also Known As: 2-methyl-N-[(4-toluidinocarbonyl)oxy]propanimidoyl chloride
| Molecular Formula | C12H15ClN2O2 |
| Molecular Weight | 254.0822 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.0822 Da |
| Heavy Atoms | 17 |
| Complexity | 284.0 |
| SMILES | CC1=CC=C(C=C1)NC(=O)ON=C(C(C)C)Cl |
| InChIKey | WZRLBBCCFXBRDY-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate is 145252-21-7.
The molecular formula of [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate is C12H15ClN2O2.
The molecular weight of [(1-chloro-2-methylpropylidene)amino] N-(4-methylphenyl)carbamate is 254.0822 g/mol.
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