N-[2-(1H-indol-3-yl)ethyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-[2-(1H-indol-3-yl)ethyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0440 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 388.49 |
| Molecular Formula: | C22 H20 N4 O S |
| Smiles: | CSc1ncc(C(NCCc2c[nH]c3ccccc23)=O)c(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.147 |
| logD: | 4.147 |
| logSw: | -4.0598 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.678 |
| InChI Key: | IERMTRBGNXVIRI-UHFFFAOYSA-N |