N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-4-methyl-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-4-methyl-1,2,3-thiadiazole-5-carboxamide
N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-4-methyl-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | D319-0401 |
| Compound Name: | N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}-4-methyl-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 426.53 |
| Molecular Formula: | C16 H18 N4 O4 S3 |
| Smiles: | [H]N(C(c1c(C)nns1)=O)c1c(C(NC2CCS(C2)(=O)=O)=O)c2CCCc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6815 |
| logD: | -2.4161 |
| logSw: | -1.9689 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.43 |
| InChI Key: | GNUNUOGSAMEZCR-SECBINFHSA-N |