propan-2-yl 2-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8010-7194 |
| Compound Name: | propan-2-yl 2-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 411.56 |
| Molecular Formula: | C17 H21 N3 O3 S3 |
| Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(CSc1nnc(C)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6789 |
| logD: | 1.6277 |
| logSw: | -4.1 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.935 |
| InChI Key: | GOCGIBIELVGOCS-UHFFFAOYSA-N |