TL;DR: (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide (CAS 1164541-59-6) is a chemical compound with molecular formula C21H17N3O2 and molecular weight 343.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide
Also Known As: AB00098636-01, (2E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide, (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide, N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(2-furyl)acrylamide, (2E)-N-(5-benzimidazol-2-yl-2-methylphenyl)-3-(2-furyl)prop-2-enamide
| Molecular Formula | C21H17N3O2 |
| Molecular Weight | 343.13208 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 70.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.13208 Da |
| Heavy Atoms | 26 |
| Complexity | 523.0 |
| SMILES | CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC(=O)/C=C/C4=CC=CO4 |
| InChIKey | LWFGRDLTULALIS-ZHACJKMWSA-N |
The XLogP value of 3.9 indicates that (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide has 2 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 (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide is 1164541-59-6.
The molecular formula of (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide is C21H17N3O2.
The molecular weight of (E)-N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-(furan-2-yl)prop-2-enamide is 343.13208 g/mol.
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