N-{[5-(2,1,3-benzothiadiazole-4-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylbenzamide
Chemical Structure Depiction of
N-{[5-(2,1,3-benzothiadiazole-4-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylbenzamide
N-{[5-(2,1,3-benzothiadiazole-4-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylbenzamide
Compound characteristics
| Compound ID: | L871-0445 |
| Compound Name: | N-{[5-(2,1,3-benzothiadiazole-4-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-N-phenylbenzamide |
| Molecular Weight: | 544.65 |
| Molecular Formula: | C27 H24 N6 O3 S2 |
| Smiles: | Cn1c2CCN(Cc2c(CN(C(c2ccccc2)=O)c2ccccc2)n1)S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6304 |
| logD: | 3.6304 |
| logSw: | -3.8614 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.428 |
| InChI Key: | XXFBJBLANRLVAE-UHFFFAOYSA-N |