3-(5-chloro-1H-benzimidazol-2-yl)-1-{8-[4-(cyclopropylmethyl)-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-(cyclopropylmethyl)-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-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}propan-1-one
Compound characteristics
| Compound ID: | SD74-0624 |
| Compound Name: | 3-(5-chloro-1H-benzimidazol-2-yl)-1-{8-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-6-azaspiro[3.4]octan-6-yl}propan-1-one |
| Molecular Weight: | 438.96 |
| Molecular Formula: | C23 H27 Cl N6 O |
| Smiles: | C1CC2(C1)CN(CC2c1nncn1CC1CC1)C(CCc1nc2cc(ccc2[nH]1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7994 |
| logD: | 2.7318 |
| logSw: | -3.5943 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.733 |
| InChI Key: | PVFUVTNRKMGDOU-KRWDZBQOSA-N |