1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(quinolin-8-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Chemical Structure Depiction of
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(quinolin-8-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(quinolin-8-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Compound characteristics
Compound ID: | D657-0066 |
Compound Name: | 1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(quinolin-8-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide |
Molecular Weight: | 410.49 |
Molecular Formula: | C21 H22 N4 O3 S |
Smiles: | [H]N(C(c1c2CCCCc2n(C2CCS(C2)(=O)=O)n1)=O)c1cccc2cccnc12 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.2836 |
logD: | 2.2833 |
logSw: | -2.738 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.952 |
InChI Key: | RODXGOGATUGXJH-OAHLLOKOSA-N |