3-(5-chloro-1H-benzimidazol-2-yl)-1-[8-(5-cyclopropyl-1H-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-(5-cyclopropyl-1H-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-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]propan-1-one
Compound characteristics
| Compound ID: | SC70-0307 |
| Compound Name: | 3-(5-chloro-1H-benzimidazol-2-yl)-1-[8-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]propan-1-one |
| Molecular Weight: | 424.93 |
| Molecular Formula: | C22 H25 Cl N6 O |
| Smiles: | C1CC2(C1)CN(CC2c1nc(C2CC2)[nH]n1)C(CCc1nc2cc(ccc2[nH]1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3764 |
| logD: | 3.3078 |
| logSw: | -3.7317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.162 |
| InChI Key: | NEEDYGURXNVUFN-HNNXBMFYSA-N |