TL;DR: Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester (CAS 123312-10-7) is a chemical compound with molecular formula C26H29NO6 and molecular weight 451.1995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-phenoxyphenyl)methyl N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)carbamate
Also Known As: Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester, (3-phenoxyphenyl)methyl N-propan-2-yl-N-(3,4,5-trimethoxyphenyl)carbamate, (3-Phenoxyphenyl)methyl propan-2-yl(3,4,5-trimethoxyphenyl)carbamate
| Molecular Formula | C26H29NO6 |
| Molecular Weight | 451.1995 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 451.1995 Da |
| Heavy Atoms | 33 |
| Complexity | 567.0 |
| SMILES | CC(C)N(C1=CC(=C(C(=C1)OC)OC)OC)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3 |
| InChIKey | CTOJWIXRHDIENK-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester. Following Lipinski's Rule of Five, Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester is 123312-10-7.
The molecular formula of Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester is C26H29NO6.
The molecular weight of Carbamic acid, (2,3,4-trimethoxyphenyl)(1-methylethyl)-, (3-phenoxyphenyl)methyl ester is 451.1995 g/mol.
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