TL;DR: Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate (CAS 1396966-25-8) is a chemical compound with molecular formula C18H21N3O4 and molecular weight 343.1532 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(6-methoxy-3-pyridinyl)carbamoylamino]-3-phenylpropanoate
Also Known As: starbld0015015, ETHYL 2-(((6-METHOXY(3-PYRIDYL))AMINO)CARBONYLAMINO)-3-PHENYLPROPANOATE, ethyl 2-{[(6-methoxypyridin-3-yl)carbamoyl]amino}-3-phenylpropanoate, Ethyl ((6-methoxypyridin-3-yl)carbamoyl)phenylalaninate, ethyl 2-[(6-methoxypyridin-3-yl)carbamoylamino]-3-phenylpropanoate
| Molecular Formula | C18H21N3O4 |
| Molecular Weight | 343.1532 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 343.1532 Da |
| Heavy Atoms | 25 |
| Complexity | 427.0 |
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)NC(=O)NC2=CN=C(C=C2)OC |
| InChIKey | DWEXCPHSUFLYFU-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate. Following Lipinski's Rule of Five, Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate 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 Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate is 1396966-25-8.
The molecular formula of Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate is C18H21N3O4.
The molecular weight of Ethyl 2-(((6-methoxy(3-pyridyl))amino)carbonylamino)-3-phenylpropanoate is 343.1532 g/mol.
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