8-benzyl-3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-benzyl-3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
8-benzyl-3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | E616-0192 |
| Compound Name: | 8-benzyl-3-methyl-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-oxa-8-azaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 490.56 |
| Molecular Formula: | C27 H30 N4 O5 |
| Smiles: | CC1=C(C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)C2(CCN(CC2)Cc2ccccc2)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.459 |
| logD: | 1.3563 |
| logSw: | -3.7007 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.895 |
| InChI Key: | OCVWNNMXNFZCHV-UHFFFAOYSA-N |