(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Chemical Structure Depiction of
(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
(1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Compound characteristics
| Compound ID: | SC69-0116 |
| Compound Name: | (1,4-dihydro[1]benzopyrano[4,3-c]pyrazol-3-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | Cn1cnnc1C1CN(CC12CCCC2)C(c1c2COc3ccccc3c2[nH]n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5828 |
| logD: | 1.5828 |
| logSw: | -2.4956 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.81 |
| InChI Key: | HJXDMSCSGMLTFC-INIZCTEOSA-N |