(4-benzylpiperazin-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone
(4-benzylpiperazin-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | C582-0802 |
| Compound Name: | (4-benzylpiperazin-1-yl)(5-methyl-4-nitro-1,2-oxazol-3-yl)methanone |
| Molecular Weight: | 330.34 |
| Molecular Formula: | C16 H18 N4 O4 |
| Smiles: | Cc1c(c(C(N2CCN(CC2)Cc2ccccc2)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.5577 |
| logD: | 1.5421 |
| logSw: | -1.8559 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.439 |
| InChI Key: | DQMCBCUSMCGAQW-UHFFFAOYSA-N |