ethyl 4,5-dimethyl-2-{[1-(3-oxo-1-benzothiophen-2(3H)-ylidene)ethyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-{[1-(3-oxo-1-benzothiophen-2(3H)-ylidene)ethyl]amino}thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-{[1-(3-oxo-1-benzothiophen-2(3H)-ylidene)ethyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3237-0127 |
| Compound Name: | ethyl 4,5-dimethyl-2-{[1-(3-oxo-1-benzothiophen-2(3H)-ylidene)ethyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 373.49 |
| Molecular Formula: | C19 H19 N O3 S2 |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(/C)=C1/C(c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6085 |
| logD: | 3.0058 |
| logSw: | -4.5406 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.169 |
| InChI Key: | IBKYDFAOSKEYJL-UHFFFAOYSA-N |