N-[4-(azepane-1-sulfonyl)phenyl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-[4-(azepane-1-sulfonyl)phenyl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 6466-1549 |
| Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 464.49 |
| Molecular Formula: | C20 H22 F2 N6 O3 S |
| Smiles: | Cc1cc(C(F)F)n2c(n1)nc(C(Nc1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.4511 |
| logD: | 2.448 |
| logSw: | -2.9597 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.992 |
| InChI Key: | ORTYCEUGQJAILB-UHFFFAOYSA-N |