TL;DR: (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid (CAS 1173678-00-6) is a chemical compound with molecular formula C21H29N3O6 and molecular weight 419.20563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid
Also Known As: (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid, (S)-4-amino-2-(1-(tert-butoxycarbonyl)-4-phenylpiperidine-4-carboxamido)-4-oxobutanoic acid
| Molecular Formula | C21H29N3O6 |
| Molecular Weight | 419.20563 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.20563 Da |
| Heavy Atoms | 30 |
| Complexity | 658.0 |
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)N[C@@H](CC(=O)N)C(=O)O |
| InChIKey | UACLPYBALYKENK-HNNXBMFYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid has 3 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 (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid is 1173678-00-6.
The molecular formula of (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid is C21H29N3O6.
The molecular weight of (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid is 419.20563 g/mol.
You can request a quote for (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for (2S)-4-amino-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 1173678-00-6. Our professional technical team will respond with pricing and lead time.