N-[2-(6-bromo-1H-indol-1-yl)ethyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide
Chemical Structure Depiction of
N-[2-(6-bromo-1H-indol-1-yl)ethyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide
N-[2-(6-bromo-1H-indol-1-yl)ethyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide
Compound characteristics
| Compound ID: | Y044-5634 |
| Compound Name: | N-[2-(6-bromo-1H-indol-1-yl)ethyl]-1',3',5'-trimethyl-1H,1'H-[3,4'-bipyrazole]-5-carboxamide |
| Molecular Weight: | 441.33 |
| Molecular Formula: | C20 H21 Br N6 O |
| Smiles: | Cc1c(c2cc(C(NCCn3ccc4ccc(cc34)[Br])=O)[nH]n2)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7468 |
| logD: | 2.7467 |
| logSw: | -3.1728 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.911 |
| InChI Key: | KVLYVKUPBNBKGU-UHFFFAOYSA-N |