N-methyl-N-{2-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}thiophene-2-sulfonamide
Chemical Structure Depiction of
N-methyl-N-{2-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}thiophene-2-sulfonamide
N-methyl-N-{2-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S565-1229 |
| Compound Name: | N-methyl-N-{2-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-oxoethyl}thiophene-2-sulfonamide |
| Molecular Weight: | 435.53 |
| Molecular Formula: | C17 H21 N7 O3 S2 |
| Smiles: | CN(CC(N1CCc2c(C1)c(c1nncn1C)nn2C)=O)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6032 |
| logD: | -0.6084 |
| logSw: | -1.8592 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.805 |
| InChI Key: | JDMYSEPNADMKKE-UHFFFAOYSA-N |