TL;DR: 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide (CAS 1212250-81-1) is a chemical compound with molecular formula C16H16N4O and molecular weight 280.13242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide
Also Known As: 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide, (S)-N-(1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)-4-methylbenzamide
| Molecular Formula | C16H16N4O |
| Molecular Weight | 280.13242 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.13242 Da |
| Heavy Atoms | 21 |
| Complexity | 367.0 |
| SMILES | CC1=CC=C(C=C1)C(=O)N[C@@H](C)C2=NN=C3N2C=CC=C3 |
| InChIKey | YHSYFMXIXLRACL-LBPRGKRZSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide. With a topological polar surface area (TPSA) of 59.3 Ų, 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide 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 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide is 1212250-81-1.
The molecular formula of 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide is C16H16N4O.
The molecular weight of 4-methyl-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]benzamide is 280.13242 g/mol.
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