1,8-dimethyl-N-(3-methylbutyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1,8-dimethyl-N-(3-methylbutyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1,8-dimethyl-N-(3-methylbutyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-0529 |
| Compound Name: | 1,8-dimethyl-N-(3-methylbutyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 329.46 |
| Molecular Formula: | C18 H23 N3 O S |
| Smiles: | CC(C)CCNC(c1c2CSc3ccc(C)cc3c2n(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5718 |
| logD: | 3.5718 |
| logSw: | -3.8465 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.088 |
| InChI Key: | HAMUQWGSQOLMDE-UHFFFAOYSA-N |