2-[(1-methyl-1H-pyrrol-2-yl)methyl]-4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonane
Chemical Structure Depiction of
2-[(1-methyl-1H-pyrrol-2-yl)methyl]-4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonane
2-[(1-methyl-1H-pyrrol-2-yl)methyl]-4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonane
Compound characteristics
| Compound ID: | SC46-0507 |
| Compound Name: | 2-[(1-methyl-1H-pyrrol-2-yl)methyl]-4-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2-azaspiro[4.4]nonane |
| Molecular Weight: | 327.47 |
| Molecular Formula: | C19 H29 N5 |
| Smiles: | CC(C)c1nc(C2CN(Cc3cccn3C)CC23CCCC3)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9978 |
| logD: | 0.8256 |
| logSw: | -3.0285 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.173 |
| InChI Key: | BLBQNKPQGGKYFG-MRXNPFEDSA-N |