N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-4-carboxamide
Chemical Structure Depiction of
N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-4-carboxamide
N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-4-carboxamide
Compound characteristics
| Compound ID: | D319-0041 |
| Compound Name: | N-(3-{[(pyridin-3-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,2,3-thiadiazole-4-carboxamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C18 H17 N5 O2 S2 |
| Smiles: | [H]N(C(c1csnn1)=O)c1c(C(NCc2cccnc2)=O)c2CCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.1293 |
| logD: | 0.3691 |
| logSw: | -2.3321 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.581 |
| InChI Key: | NMONPZCJIMVPFS-UHFFFAOYSA-N |