pentyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
pentyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
pentyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0304 |
| Compound Name: | pentyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C19 H23 N O3 S |
| Smiles: | CCCCCOC(c1c(C)c2C(CC(Cc2[nH]1)c1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5883 |
| logD: | 4.5883 |
| logSw: | -4.4802 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.107 |
| InChI Key: | NRRSVDPTUBXUEE-ZDUSSCGKSA-N |