N-benzyl-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide
N-benzyl-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | IB05-5054 |
| Compound Name: | N-benzyl-4-(4-methoxyphenyl)-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 325.39 |
| Molecular Formula: | C17 H15 N3 O2 S |
| Smiles: | COc1ccc(cc1)c1c(C(NCc2ccccc2)=O)snn1 |
| Stereo: | ACHIRAL |
| logP: | 3.13 |
| logD: | 3.13 |
| logSw: | -3.81 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.39 |
| InChI Key: | QYYRVVKMBXKRKR-UHFFFAOYSA-N |