ethyl 2-{2-[(4,5-dihydro-1,3-thiazol-2-yl)sulfanyl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(4,5-dihydro-1,3-thiazol-2-yl)sulfanyl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{2-[(4,5-dihydro-1,3-thiazol-2-yl)sulfanyl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8008-3321 |
| Compound Name: | ethyl 2-{2-[(4,5-dihydro-1,3-thiazol-2-yl)sulfanyl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 412.59 |
| Molecular Formula: | C18 H24 N2 O3 S3 |
| Smiles: | CCC(C(Nc1c(C(=O)OCC)c2CCCCc2s1)=O)SC1=NCCS1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6262 |
| logD: | 2.1029 |
| logSw: | -4.3284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.512 |
| InChI Key: | KKQUUGQFOQXLQV-LBPRGKRZSA-N |