TL;DR: (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e. (CAS 156406-42-7) is a chemical compound with molecular formula C11H17NO and molecular weight 179.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol
Also Known As: (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol, 4914AD, (S)-3-Amino-2,2-dimethyl-3-phenylpropan-1-ol, 3-amino-2,2-dimethyl-3-phenyl-propan-1-ol, (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e.
| Molecular Formula | C11H17NO |
| Molecular Weight | 179.13101 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.13101 Da |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
| SMILES | CC(C)(CO)[C@H](C1=CC=CC=C1)N |
| InChIKey | JROIRYAZVQTFDW-JTQLQIEISA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e.. With a topological polar surface area (TPSA) of 46.3 Ų, (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e. exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e. has 2 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 (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e. is 156406-42-7.
The molecular formula of (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e. is C11H17NO.
The molecular weight of (3S)-3-amino-2,2-dimethyl-3-phenylpropan-1-ol >99% e.e. is 179.13101 g/mol.
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