TL;DR: (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide (CAS 1173677-89-8) is a chemical compound with molecular formula C21H25N5O3 and molecular weight 395.19574 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S)-1-(furan-2-ylmethylamino)-4-methyl-1-oxopentan-2-yl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide
Also Known As: (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide, N-[(2S)-1-(furan-2-ylmethylamino)-4-methyl-1-oxopentan-2-yl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide, N-{(2S)-1-[(furan-2-ylmethyl)amino]-4-methyl-1-oxopentan-2-yl}-2,3-dihydro-1H-imidazo[1,2-a]benzimidazole-1-carboxamide
| Molecular Formula | C21H25N5O3 |
| Molecular Weight | 395.19574 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.19574 Da |
| Heavy Atoms | 29 |
| Complexity | 601.0 |
| SMILES | CC(C)C[C@@H](C(=O)NCC1=CC=CO1)NC(=O)N2CCN3C2=NC4=CC=CC=C43 |
| InChIKey | LPJOKBQUPJGNRH-KRWDZBQOSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide. Following Lipinski's Rule of Five, (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide has 2 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 (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide is 1173677-89-8.
The molecular formula of (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide is C21H25N5O3.
The molecular weight of (S)-N-(1-((furan-2-ylmethyl)amino)-4-methyl-1-oxopentan-2-yl)-2,3-dihydro-1H-benzo[d]imidazo[1,2-a]imidazole-1-carboxamide is 395.19574 g/mol.
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