1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
Compound ID: | E146-1587 |
Compound Name: | 1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
Molecular Weight: | 375.49 |
Molecular Formula: | C22 H21 N3 O S |
Smiles: | Cn1c2c3ccccc3SCc2c(C(NC2CCCc3ccccc23)=O)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9169 |
logD: | 3.9168 |
logSw: | -3.9821 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.819 |
InChI Key: | RKOJOYSLQPODSI-SFHVURJKSA-N |