1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-3-(4-methoxyphenyl)propan-1-one
Chemical Structure Depiction of
1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-3-(4-methoxyphenyl)propan-1-one
1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-3-(4-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | SB59-0677 |
| Compound Name: | 1-[6-benzyl-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-3-(4-methoxyphenyl)propan-1-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C26 H31 N5 O2 |
| Smiles: | Cn1cnnc1C1CN(Cc2ccccc2)CC12CN(C2)C(CCc1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2953 |
| logD: | -1.1129 |
| logSw: | -2.3549 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.707 |
| InChI Key: | MEQWGXDFGPHAGJ-HSZRJFAPSA-N |