2-methyl-1-{2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one
Chemical Structure Depiction of
2-methyl-1-{2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one
2-methyl-1-{2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one
Compound characteristics
| Compound ID: | SB59-0421 |
| Compound Name: | 2-methyl-1-{2-[(5-methylthiophen-2-yl)methyl]-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one |
| Molecular Weight: | 373.52 |
| Molecular Formula: | C19 H27 N5 O S |
| Smiles: | CC(C)C(N1CC(c2nncn2C)C2(CN(Cc3ccc(C)s3)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.716 |
| logD: | -3.1556 |
| logSw: | -2.3271 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.98 |
| InChI Key: | UPXFTIDHTULHFD-MRXNPFEDSA-N |