3-methyl-1-(2-{2-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)butan-1-one
Chemical Structure Depiction of
3-methyl-1-(2-{2-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)butan-1-one
3-methyl-1-(2-{2-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)butan-1-one
Compound characteristics
| Compound ID: | T505-1502 |
| Compound Name: | 3-methyl-1-(2-{2-[4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]ethyl}piperidin-1-yl)butan-1-one |
| Molecular Weight: | 361.49 |
| Molecular Formula: | C19 H31 N5 O2 |
| Smiles: | CC(C)CC(N1CCCCC1CCn1cc(C(N2CCCC2)=O)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1471 |
| logD: | 2.1471 |
| logSw: | -2.0076 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.783 |
| InChI Key: | RKQPKFZSMGIEHL-MRXNPFEDSA-N |