N-cyclopentyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
N-cyclopentyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
N-cyclopentyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
| Compound ID: | C094-2405 |
| Compound Name: | N-cyclopentyl-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C21 H27 N3 O7 |
| Smiles: | C1CCC(C1)NC(C(c1cc2c(cc1[N+]([O-])=O)OCO2)N1CCC2(CC1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4741 |
| logD: | 2.0246 |
| logSw: | -2.8643 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.401 |
| InChI Key: | YVAXYKNWEACLGL-LJQANCHMSA-N |