TL;DR: 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide (CAS 1212253-44-5) is a chemical compound with molecular formula C18H18Cl2N4O2 and molecular weight 392.0807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide
Also Known As: 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide, (S)-N-(1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)-4-(2,4-dichlorophenoxy)butanamide
| Molecular Formula | C18H18Cl2N4O2 |
| Molecular Weight | 392.0807 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.0807 Da |
| Heavy Atoms | 26 |
| Complexity | 470.0 |
| SMILES | C[C@@H](C1=NN=C2N1C=CC=C2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl |
| InChIKey | YKSDDPOLVQRQJK-LBPRGKRZSA-N |
The XLogP value of 3.9 indicates that 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide. Following Lipinski's Rule of Five, 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide is 1212253-44-5.
The molecular formula of 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide is C18H18Cl2N4O2.
The molecular weight of 4-(2,4-dichlorophenoxy)-N-[(1S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]butanamide is 392.0807 g/mol.
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