TL;DR: 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride (CAS 130533-80-1) is a chemical compound with molecular formula C26H37ClN2O4 and molecular weight 476.24417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(morpholin-4-ylmethyl)phenyl] N-(2-octoxyphenyl)carbamate;hydrochloride
Also Known As: 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride, Carbamic acid, (2-(octyloxy)phenyl)-, 2-(4-morpholinylmethyl)phenyl ester, monohydrochloride, [2-(morpholin-4-ylmethyl)phenyl] N-(2-octoxyphenyl)carbamate hydrochloride, 2-[(Morpholin-4-yl)methyl]phenyl [2-(octyloxy)phenyl]carbamate--hydrogen chloride (1/1)
| Molecular Formula | C26H37ClN2O4 |
| Molecular Weight | 476.24417 g/mol |
| XLogP | 6.2908 |
| Topological Polar Surface Area (TPSA) | 60.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 476.24417 Da |
| Heavy Atoms | 33 |
| Complexity | 512.0 |
| SMILES | CCCCCCCCOC1=CC=CC=C1NC(=O)OC2=CC=CC=C2CN3CCOCC3.Cl |
| InChIKey | OWZWECOAXWTZJW-UHFFFAOYSA-N |
The XLogP value of 6.2908 indicates that 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride. Following Lipinski's Rule of Five, 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride is 130533-80-1.
The molecular formula of 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride is C26H37ClN2O4.
The molecular weight of 2-(4-Morpholinylmethyl)phenyl (2-(octyloxy)phenyl)carbamate monohydrochloride is 476.24417 g/mol.
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