4-methyl-N-{3-[(2-phenylethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
4-methyl-N-{3-[(2-phenylethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1,2,3-thiadiazole-5-carboxamide
4-methyl-N-{3-[(2-phenylethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | D319-0406 |
| Compound Name: | 4-methyl-N-{3-[(2-phenylethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C21 H22 N4 O2 S2 |
| Smiles: | [H]N(C(c1c(C)nns1)=O)c1c(C(NCCc2ccccc2)=O)c2CCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.393 |
| logD: | 0.316 |
| logSw: | -3.9998 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.743 |
| InChI Key: | BZPKLELTPRRRFK-UHFFFAOYSA-N |