TL;DR: Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1) (CAS 63982-52-5) is a chemical compound with molecular formula C14H20N2O4 and molecular weight 280.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-methyl-4-(methylcarbamoyloxy)-5-propan-2-ylphenyl] N-methylcarbamate
Also Known As: Benzene, 1,4-bis(methylcarbamyloxy)-2-isopropyl-5-methyl-, CARBAMIC ACID, METHYL-, (2-ISOPROPYL-5-METHYL-1,4-PHENYLENE) ESTER (2:1), 2-Methyl-5-(propan-2-yl)-1,4-phenylene bis(methylcarbamate), [2-methyl-4-(methylcarbamoyloxy)-5-propan-2-ylphenyl] N-methylcarbamate, 1,4-Benzenediol, 2-methyl-5-(1-methylethyl)-, bis(methylcarbamate)
| Molecular Formula | C14H20N2O4 |
| Molecular Weight | 280.1423 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.1423 Da |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
| SMILES | CC1=CC(=C(C=C1OC(=O)NC)C(C)C)OC(=O)NC |
| InChIKey | XOXMOVDDZFAZSM-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1). The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1). Following Lipinski's Rule of Five, Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1) 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 Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1) is 63982-52-5.
The molecular formula of Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1) is C14H20N2O4.
The molecular weight of Carbamic acid, methyl-, (2-isopropyl-5-methyl-1,4-phenylene) ester (2:1) is 280.1423 g/mol.
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