methyl 2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzoxazole-5-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzoxazole-5-carboxylate
methyl 2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzoxazole-5-carboxylate
Compound characteristics
| Compound ID: | 8018-7181 |
| Compound Name: | methyl 2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzoxazole-5-carboxylate |
| Molecular Weight: | 368.41 |
| Molecular Formula: | C19 H16 N2 O4 S |
| Smiles: | COC(c1ccc2c(c1)nc(o2)SCC(N1CCc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6304 |
| logD: | 3.6304 |
| logSw: | -3.976 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.227 |
| InChI Key: | VAKJSUREQVMCLZ-UHFFFAOYSA-N |