N-[3-(1H-benzimidazol-2-yl)propyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide
Chemical Structure Depiction of
N-[3-(1H-benzimidazol-2-yl)propyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide
N-[3-(1H-benzimidazol-2-yl)propyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide
Compound characteristics
| Compound ID: | Y042-6613 |
| Compound Name: | N-[3-(1H-benzimidazol-2-yl)propyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide |
| Molecular Weight: | 377.45 |
| Molecular Formula: | C20 H23 N7 O |
| Smiles: | Cc1c(c2cc(C(NCCCc3nc4ccccc4[nH]3)=O)[nH]n2)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6231 |
| logD: | 1.6153 |
| logSw: | -2.2314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.104 |
| InChI Key: | RQSJHYWGFCSWJT-UHFFFAOYSA-N |