3-{2-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
3-{2-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SC69-0109 |
| Compound Name: | 3-{2-[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C20 H23 N5 O3 |
| Smiles: | Cn1cnnc1C1CN(CC12CCCC2)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8667 |
| logD: | 0.8666 |
| logSw: | -1.6853 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.891 |
| InChI Key: | JSEDDSBBDAIQGH-AWEZNQCLSA-N |