TL;DR: RefChem:237574 (CAS 141246-02-8) is a chemical compound with molecular formula C19H19ClN2O2 and molecular weight 342.1135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[5-chloro-2-[(4-methylphenyl)methyl]benzimidazol-1-yl]butanoic acid
Also Known As: 5-Chloro-beta-methyl-2-((4-methylphenyl)methyl)-1H-benzimidazole-1-propanoic acid, 1H-Benzimidazole-1-propanoic acid, 5-chloro-beta-methyl-2-((4-methylphenyl)methyl)-, 3-[2-[4-Methylbenzyl]-5-chloro-1H-benzimidazol-1-yl]butanoic acid, 3-[5-chloro-2-[(4-methylphenyl)methyl]benzimidazol-1-yl]butanoic acid, 3-{5-Chloro-2-[(4-methylphenyl)methyl]-1H-benzimidazol-1-yl}butanoic acid
| Molecular Formula | C19H19ClN2O2 |
| Molecular Weight | 342.1135 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.1135 Da |
| Heavy Atoms | 24 |
| Complexity | 439.0 |
| SMILES | CC1=CC=C(C=C1)CC2=NC3=C(N2C(C)CC(=O)O)C=CC(=C3)Cl |
| InChIKey | GGFDXYZTXQPHDY-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that RefChem:237574 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, RefChem:237574 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:237574 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 RefChem:237574 is 141246-02-8.
The molecular formula of RefChem:237574 is C19H19ClN2O2.
The molecular weight of RefChem:237574 is 342.1135 g/mol.
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