N-[(5-methyl-1H-benzimidazol-2-yl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(5-methyl-1H-benzimidazol-2-yl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-[(5-methyl-1H-benzimidazol-2-yl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G637-0692 |
| Compound Name: | N-[(5-methyl-1H-benzimidazol-2-yl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 533.65 |
| Molecular Formula: | C28 H31 N5 O4 S |
| Smiles: | Cc1ccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(NCc2nc3cc(C)ccc3[nH]2)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0971 |
| logD: | 4.0968 |
| logSw: | -4.157 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.16 |
| InChI Key: | AWJLGXIUOSHQNC-UHFFFAOYSA-N |