TL;DR: N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide (CAS 1099594-72-5) is a chemical compound with molecular formula C19H30N2OS and molecular weight 334.2079 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide
Also Known As: N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide, N-(Cyclohexylmethyl)-N~2~-methyl-N~2~-{[4-(methylsulfanyl)phenyl]methyl}alaninamide
| Molecular Formula | C19H30N2OS |
| Molecular Weight | 334.2079 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.2079 Da |
| Heavy Atoms | 23 |
| Complexity | 349.0 |
| SMILES | CC(C(=O)NCC1CCCCC1)N(C)CC2=CC=C(C=C2)SC |
| InChIKey | IBGGKOLAUJMDKJ-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide has 1 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-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide is 1099594-72-5.
The molecular formula of N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide is C19H30N2OS.
The molecular weight of N-(cyclohexylmethyl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide is 334.2079 g/mol.
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