TL;DR: methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate (CAS 1173665-54-7) is a chemical compound with molecular formula C15H22N2O4 and molecular weight 294.15796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-2-(3-methoxypropylcarbamoylamino)-3-phenylpropanoate
Also Known As: methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate, (S)-methyl 2-(3-(3-methoxypropyl)ureido)-3-phenylpropanoate
| Molecular Formula | C15H22N2O4 |
| Molecular Weight | 294.15796 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 294.15796 Da |
| Heavy Atoms | 21 |
| Complexity | 317.0 |
| SMILES | COCCCNC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC |
| InChIKey | QGKGTCSMEHPWIJ-ZDUSSCGKSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate. Following Lipinski's Rule of Five, methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate has 2 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 methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate is 1173665-54-7.
The molecular formula of methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate is C15H22N2O4.
The molecular weight of methyl N-[(3-methoxypropyl)carbamoyl]-L-phenylalaninate is 294.15796 g/mol.
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