N-[(4-bromophenyl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-[(4-bromophenyl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G637-0806 |
| Compound Name: | N-[(4-bromophenyl)methyl]-1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 558.49 |
| Molecular Formula: | C26 H28 Br N3 O4 S |
| Smiles: | Cc1ccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(NCc2ccc(cc2)[Br])=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4944 |
| logD: | 4.4944 |
| logSw: | -4.133 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.878 |
| InChI Key: | UHCPXKFWACJEOJ-UHFFFAOYSA-N |