TL;DR: Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- (CAS 115030-33-6) is a chemical compound with molecular formula C23H30N2OS and molecular weight 382.2079 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-[3-(4-benzylpiperidin-1-yl)propylsulfanyl]phenyl]acetamide
Also Known As: Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)-, N-(4-((3-(4-(Phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)acetamide, N-(4-{[3-(4-Benzylpiperidin-1-yl)propyl]sulfanyl}phenyl)acetamide, N-[4-[3-(4-benzylpiperidin-1-yl)propylsulfanyl]phenyl]acetamide, BRN 5131997
| Molecular Formula | C23H30N2OS |
| Molecular Weight | 382.2079 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.2079 Da |
| Heavy Atoms | 27 |
| Complexity | 422.0 |
| SMILES | CC(=O)NC1=CC=C(C=C1)SCCCN2CCC(CC2)CC3=CC=CC=C3 |
| InChIKey | SXCJJLHZRWFVBT-UHFFFAOYSA-N |
The XLogP value of 4.7 indicates that Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- 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 Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- is 115030-33-6.
The molecular formula of Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- is C23H30N2OS.
The molecular weight of Acetamide, N-(4-((3-(4-(phenylmethyl)-1-piperidinyl)propyl)thio)phenyl)- is 382.2079 g/mol.
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