ethyl 5,5-dimethyl-2-{[(prop-2-en-1-yl)carbamothioyl]amino}-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate
Chemical Structure Depiction of
ethyl 5,5-dimethyl-2-{[(prop-2-en-1-yl)carbamothioyl]amino}-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate
ethyl 5,5-dimethyl-2-{[(prop-2-en-1-yl)carbamothioyl]amino}-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8016-2463 |
| Compound Name: | ethyl 5,5-dimethyl-2-{[(prop-2-en-1-yl)carbamothioyl]amino}-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate |
| Molecular Weight: | 370.55 |
| Molecular Formula: | C16 H22 N2 O2 S3 |
| Smiles: | CCOC(c1c2CC(C)(C)SCc2sc1NC(NCC=C)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9667 |
| logD: | 3.6181 |
| logSw: | -4.1955 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.965 |
| InChI Key: | FSTHPPUKNSBDSH-UHFFFAOYSA-N |