4-methyl-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
4-methyl-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-5-carboxamide
4-methyl-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | D319-0345 |
| Compound Name: | 4-methyl-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C19 H19 N5 O2 S2 |
| Smiles: | [H]N(C(c1c(C)nns1)=O)c1c(C(NCc2cccnc2)=O)c2CCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.2317 |
| logD: | -0.5881 |
| logSw: | -2.2942 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.419 |
| InChI Key: | HFXQLPVPTOQWSD-UHFFFAOYSA-N |