5-[(3-bromophenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-2-(furan-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Chemical Structure Depiction of
5-[(3-bromophenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-2-(furan-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
5-[(3-bromophenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-2-(furan-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Compound characteristics
| Compound ID: | G857-1777 |
| Compound Name: | 5-[(3-bromophenyl)(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-2-(furan-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol |
| Molecular Weight: | 517.4 |
| Molecular Formula: | C22 H21 Br N4 O4 S |
| Smiles: | C1CN(CCC12OCCO2)C(c1cccc(c1)[Br])c1c(n2c(nc(c3ccco3)n2)s1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8439 |
| logD: | 3.8439 |
| logSw: | -3.8958 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.909 |
| InChI Key: | OTKDBQHMPMLJLI-QGZVFWFLSA-N |