[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid
Chemical Structure Depiction of
[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid
[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid
Compound characteristics
| Compound ID: | 8009-4079 |
| Compound Name: | [1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid |
| Molecular Weight: | 235.3 |
| Molecular Formula: | C12 H13 N O2 S |
| Smiles: | Cn1c(CC(O)=O)c(c2ccccc12)SC |
| Stereo: | ACHIRAL |
| logP: | 1.9534 |
| logD: | -2.035 |
| logSw: | -2.235 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.4147 |
| InChI Key: | WQWDWRNNBRSVMJ-UHFFFAOYSA-N |