2-methyl-1-[2-(1-methylcyclohexane-1-carbonyl)-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-(1-methylcyclohexane-1-carbonyl)-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-(1-methylcyclohexane-1-carbonyl)-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: | SB59-0458 |
Compound Name: | 2-methyl-1-[2-(1-methylcyclohexane-1-carbonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]propan-1-one |
Molecular Weight: | 387.52 |
Molecular Formula: | C21 H33 N5 O2 |
Smiles: | CC(C)C(N1CC(c2nncn2C)C2(C1)CN(C2)C(C1(C)CCCCC1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.5522 |
logD: | 1.552 |
logSw: | -1.4716 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 59.07 |
InChI Key: | XSDZABOXEMUGLY-MRXNPFEDSA-N |