2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[2-(1H-indol-3-yl)ethyl]pteridin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[2-(1H-indol-3-yl)ethyl]pteridin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[2-(1H-indol-3-yl)ethyl]pteridin-4(3H)-one
Compound characteristics
| Compound ID: | E196-0242 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[2-(1H-indol-3-yl)ethyl]pteridin-4(3H)-one |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C23 H18 Cl N5 O S |
| Smiles: | C(CN1C(=Nc2c(C1=O)nccn2)SCc1ccc(cc1)[Cl])c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.1865 |
| logD: | 4.1865 |
| logSw: | -4.5912 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.153 |
| InChI Key: | XTUGIGHLKLPRQR-UHFFFAOYSA-N |