3-(5-chloro-1H-benzimidazol-2-yl)-1-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]propan-1-one
Chemical Structure Depiction of
3-(5-chloro-1H-benzimidazol-2-yl)-1-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]propan-1-one
3-(5-chloro-1H-benzimidazol-2-yl)-1-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]propan-1-one
Compound characteristics
| Compound ID: | SD74-0414 |
| Compound Name: | 3-(5-chloro-1H-benzimidazol-2-yl)-1-[8-(4-propyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]propan-1-one |
| Molecular Weight: | 426.95 |
| Molecular Formula: | C22 H27 Cl N6 O |
| Smiles: | CCCn1cnnc1C1CN(CC12CCC2)C(CCc1nc2cc(ccc2[nH]1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7033 |
| logD: | 2.6357 |
| logSw: | -3.502 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.46 |
| InChI Key: | KJGYHXMNFMTUOE-INIZCTEOSA-N |