TL;DR: Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- (CAS 112603-66-4) is a chemical compound with molecular formula C20H30N2O2 and molecular weight 330.23074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S)-4-methyl-1-oxo-1-pyrrolidin-1-ylpentan-2-yl]-4-phenylbutanamide
Also Known As: SUAM 1253, Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)-, (S)-N-(3-Methyl-1-(1-pyrrolidinylcarbonyl)butyl)benzenebutanamide, N-[(2S)-4-methyl-1-oxo-1-pyrrolidin-1-ylpentan-2-yl]-4-phenylbutanamide, N-[(2S)-4-METHYL-1-OXO-1-(PYRROLIDIN-1-YL)PENTAN-2-YL]-4-PHENYLBUTANAMIDE
| Molecular Formula | C20H30N2O2 |
| Molecular Weight | 330.23074 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 330.23074 Da |
| Heavy Atoms | 24 |
| Complexity | 396.0 |
| SMILES | CC(C)C[C@@H](C(=O)N1CCCC1)NC(=O)CCCC2=CC=CC=C2 |
| InChIKey | XOHGSZCXFGJRDJ-SFHVURJKSA-N |
The XLogP value of 3.5 indicates that Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- is 112603-66-4.
The molecular formula of Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- is C20H30N2O2.
The molecular weight of Benzenebutanamide, N-(3-methyl-1-(1-pyrrolidinylcarbonyl)butyl)-, (S)- is 330.23074 g/mol.
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