TL;DR: (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester (CAS 110080-46-1) is a chemical compound with molecular formula C20H26N2O3 and molecular weight 342.19434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl N-(2-methoxyphenyl)-N-phenylcarbamate
Also Known As: K 77, 2-(Diethylamino)ethyl o-methoxy-N-phenylcarbanilate, (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester, 4-13-00-00855 (Beilstein Handbook Reference), CARBANILIC ACID, o-METHOXY-N-PHENYL-, 2-(DIETHYLAMINO)ETHYL ESTER
| Molecular Formula | C20H26N2O3 |
| Molecular Weight | 342.19434 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 342.19434 Da |
| Heavy Atoms | 25 |
| Complexity | 381.0 |
| SMILES | CCN(CC)CCOC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2OC |
| InChIKey | ZVWIDSJXXGFFTH-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester has 0 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 (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester is 110080-46-1.
The molecular formula of (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester is C20H26N2O3.
The molecular weight of (o-Methoxyphenyl)phenylcarbamic acid 2-(diethylamino)ethyl ester is 342.19434 g/mol.
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