N-{[5-(4-ethylbenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylacetamide
Chemical Structure Depiction of
N-{[5-(4-ethylbenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylacetamide
N-{[5-(4-ethylbenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | L871-0072 |
| Compound Name: | N-{[5-(4-ethylbenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylacetamide |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C24 H28 N4 O3 S |
| Smiles: | CCc1ccc(cc1)S(N1CCc2c(C1)c(CN(C(C)=O)c1ccccc1)nn2C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1987 |
| logD: | 3.1987 |
| logSw: | -3.4354 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.215 |
| InChI Key: | PBTNPGNPGZUMEK-UHFFFAOYSA-N |