TL;DR: (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide (CAS 1212146-79-6) is a chemical compound with molecular formula C20H29N3O5S and molecular weight 423.1828 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methoxyphenyl)sulfonyl-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidine-4-carboxamide
Also Known As: (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide, 1-(4-methoxyphenyl)sulfonyl-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidine-4-carboxamide, 1-[(4-methoxyphenyl)sulfonyl]-N-[(2S)-1-oxo-1-(pyrrolidin-1-yl)propan-2-yl]piperidine-4-carboxamide
| Molecular Formula | C20H29N3O5S |
| Molecular Weight | 423.1828 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.1828 Da |
| Heavy Atoms | 29 |
| Complexity | 671.0 |
| SMILES | C[C@@H](C(=O)N1CCCC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC |
| InChIKey | SKJOALVOQHLTBC-HNNXBMFYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide. Following Lipinski's Rule of Five, (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide is 1212146-79-6.
The molecular formula of (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide is C20H29N3O5S.
The molecular weight of (S)-1-((4-methoxyphenyl)sulfonyl)-N-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)piperidine-4-carboxamide is 423.1828 g/mol.
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