2-{[7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
Chemical Structure Depiction of
2-{[7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
2-{[7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
Compound characteristics
| Compound ID: | C091-0171 |
| Compound Name: | 2-{[7-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol |
| Molecular Weight: | 365.34 |
| Molecular Formula: | C15 H19 N5 O6 |
| Smiles: | C1CN(CCC12OCCO2)c1cc(c(c2c1non2)[N+]([O-])=O)NCCO |
| Stereo: | ACHIRAL |
| logP: | 1.7772 |
| logD: | 1.7772 |
| logSw: | -2.0942 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.772 |
| InChI Key: | UGCGKDBVRZGHFY-UHFFFAOYSA-N |