N-(2-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-oxoethyl)-N-methylthiophene-2-sulfonamide
Chemical Structure Depiction of
N-(2-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-oxoethyl)-N-methylthiophene-2-sulfonamide
N-(2-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-oxoethyl)-N-methylthiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S565-1468 |
| Compound Name: | N-(2-{3-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-oxoethyl)-N-methylthiophene-2-sulfonamide |
| Molecular Weight: | 475.59 |
| Molecular Formula: | C20 H25 N7 O3 S2 |
| Smiles: | CN(CC(N1CCc2c(C1)c(c1nncn1CC1CC1)nn2C)=O)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3194 |
| logD: | 0.3182 |
| logSw: | -2.0403 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.501 |
| InChI Key: | ZIDGTVVBUDPXCI-UHFFFAOYSA-N |