methyl 3-{2-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]hydrazinyl}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{2-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]hydrazinyl}thiophene-2-carboxylate
methyl 3-{2-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]hydrazinyl}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | K048-0021 |
| Compound Name: | methyl 3-{2-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]hydrazinyl}thiophene-2-carboxylate |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C19 H21 N3 O3 S |
| Smiles: | COC(c1c(ccs1)N/N=C/c1cc2CCCN3CCCc(c23)c1O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0059 |
| logD: | 3.9961 |
| logSw: | -4.1214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.232 |
| InChI Key: | KTYSHFYZHYEUAY-UHFFFAOYSA-N |