TL;DR: Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester (CAS 1397000-92-8) is a chemical compound with molecular formula C18H23N3O4 and molecular weight 345.16885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-(1H-indol-3-yl)-2-[(2-morpholin-4-ylacetyl)amino]propanoate
Also Known As: Methyl N-[(morpholin-4-yl)acetyl]tryptophanate, Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester, Methyl 3-(1H-indol-3-yl)-2-[(2-morpholin-4-ylacetyl)amino]propanoate, methyl 3-(1H-indol-3-yl)-2-[2-(morpholin-4-yl)acetamido]propanoate
| Molecular Formula | C18H23N3O4 |
| Molecular Weight | 345.16885 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 83.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.16885 Da |
| Heavy Atoms | 25 |
| Complexity | 467.0 |
| SMILES | COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CN3CCOCC3 |
| InChIKey | RSFWYDMIQSTECP-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester. The TPSA of 83.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester. Following Lipinski's Rule of Five, Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester 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 Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester is 1397000-92-8.
The molecular formula of Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester is C18H23N3O4.
The molecular weight of Tryptophan, N-[2-(4-morpholinyl)acetyl]-, methyl ester is 345.16885 g/mol.
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