TL;DR: N-(cyclooctylcarbamoyl)-D-phenylalanine (CAS 1173684-30-4) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-(cyclooctylcarbamoylamino)-3-phenylpropanoic acid
Also Known As: N-(cyclooctylcarbamoyl)-D-phenylalanine, (R)-2-(3-cyclooctylureido)-3-phenylpropanoic acid, 2-(cyclooctylcarbamoylamino)-3-phenyl-propanoic Acid, (2R)-2-(cyclooctylcarbamoylamino)-3-phenylpropanoic acid
| Molecular Formula | C18H26N2O3 |
| Molecular Weight | 318.19434 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.19434 Da |
| Heavy Atoms | 23 |
| Complexity | 372.0 |
| SMILES | C1CCCC(CCC1)NC(=O)N[C@H](CC2=CC=CC=C2)C(=O)O |
| InChIKey | MYOAUFUSCGJIEW-MRXNPFEDSA-N |
The XLogP value of 3.8 indicates that N-(cyclooctylcarbamoyl)-D-phenylalanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(cyclooctylcarbamoyl)-D-phenylalanine. Following Lipinski's Rule of Five, N-(cyclooctylcarbamoyl)-D-phenylalanine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(cyclooctylcarbamoyl)-D-phenylalanine is 1173684-30-4.
The molecular formula of N-(cyclooctylcarbamoyl)-D-phenylalanine is C18H26N2O3.
The molecular weight of N-(cyclooctylcarbamoyl)-D-phenylalanine is 318.19434 g/mol.
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