ethyl 2-[(2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-3203 |
| Compound Name: | ethyl 2-[(2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 422.59 |
| Molecular Formula: | C25 H30 N2 O2 S |
| Smiles: | CCOC(c1c2CCCCc2sc1/N=C1/c2ccccc2CC2(CCCCC2)N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9386 |
| logD: | 5.9386 |
| logSw: | -5.3913 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.31 |
| InChI Key: | HHFNPFUJXQKQTD-UHFFFAOYSA-N |