(4-methylphenyl)methyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
(4-methylphenyl)methyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
(4-methylphenyl)methyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0418 |
| Compound Name: | (4-methylphenyl)methyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C22 H21 N O3 S |
| Smiles: | Cc1ccc(COC(c2c(C)c3C(CC(Cc3[nH]2)c2cccs2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5506 |
| logD: | 4.5506 |
| logSw: | -4.7389 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.917 |
| InChI Key: | ZOWUVIRVCJQEOV-INIZCTEOSA-N |