TL;DR: 2-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride (CAS 112923-02-1) is a chemical compound with molecular formula C20H33ClN2O4 and molecular weight 400.2129 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-morpholin-4-ylethyl N-(4-heptoxyphenyl)carbamate;hydrochloride
Also Known As: 2-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride, Carbamic acid, (4-(heptyloxy)phenyl)-, 2-(morpholino)ethyl ester, monohydrochloride, 2-morpholin-4-ylethyl N-(4-heptoxyphenyl)carbamate hydrochloride, 2-(Morpholin-4-yl)ethyl [4-(heptyloxy)phenyl]carbamate--hydrogen chloride (1/1)
| Molecular Formula | C20H33ClN2O4 |
| Molecular Weight | 400.2129 g/mol |
| XLogP | 4.3383 |
| Topological Polar Surface Area (TPSA) | 60.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 400.2129 Da |
| Heavy Atoms | 27 |
| Complexity | 367.0 |
| SMILES | CCCCCCCOC1=CC=C(C=C1)NC(=O)OCCN2CCOCC2.Cl |
| InChIKey | IDWANCWTYAPHCA-UHFFFAOYSA-N |
The XLogP value of 4.3383 indicates that 2-(Morpholino)ethyl (4-(heptyloxy)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-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride. Following Lipinski's Rule of Five, 2-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride is 112923-02-1.
The molecular formula of 2-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride is C20H33ClN2O4.
The molecular weight of 2-(Morpholino)ethyl (4-(heptyloxy)phenyl)carbamate monohydrochloride is 400.2129 g/mol.
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