(4-benzylpiperazin-1-yl)[4-nitro-5-(propan-2-yl)-1,2-oxazol-3-yl]methanone
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)[4-nitro-5-(propan-2-yl)-1,2-oxazol-3-yl]methanone
(4-benzylpiperazin-1-yl)[4-nitro-5-(propan-2-yl)-1,2-oxazol-3-yl]methanone
Compound characteristics
| Compound ID: | C582-0910 |
| Compound Name: | (4-benzylpiperazin-1-yl)[4-nitro-5-(propan-2-yl)-1,2-oxazol-3-yl]methanone |
| Molecular Weight: | 358.4 |
| Molecular Formula: | C18 H22 N4 O4 |
| Smiles: | CC(C)c1c(c(C(N2CCN(CC2)Cc2ccccc2)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5402 |
| logD: | 2.5246 |
| logSw: | -2.4194 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.017 |
| InChI Key: | LANGVIPZIQGPJB-UHFFFAOYSA-N |