4-(2-{8-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-(2-{8-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one
4-(2-{8-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | SD74-0492 |
| Compound Name: | 4-(2-{8-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H29 N5 O3 |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCC2)C(CN1C(COc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3277 |
| logD: | 1.3277 |
| logSw: | -2.0386 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.301 |
| InChI Key: | FZOXPSCTKUMBNM-KRWDZBQOSA-N |