5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-6-nitro-2-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-6-nitro-2-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-isoindole-1,3(2H)-dione
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-6-nitro-2-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K906-0485 |
| Compound Name: | 5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-6-nitro-2-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 463.49 |
| Molecular Formula: | C25 H25 N3 O6 |
| Smiles: | C1CCc2c(C1)cccc2N1C(c2cc(c(cc2C1=O)N1CCC2(CC1)OCCO2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9971 |
| logD: | 3.9971 |
| logSw: | -4.3385 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.169 |
| InChI Key: | DBDVSFZGSVVMCU-UHFFFAOYSA-N |