2-anilino-N-[2-(1H-indol-3-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-anilino-N-[2-(1H-indol-3-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
2-anilino-N-[2-(1H-indol-3-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | K284-7832 |
| Compound Name: | 2-anilino-N-[2-(1H-indol-3-yl)ethyl]-5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide |
| Molecular Weight: | 480.55 |
| Molecular Formula: | C26 H20 N6 O2 S |
| Smiles: | C(CNC(c1ccc2C(N3C(=Nc2c1)SC(Nc1ccccc1)=N3)=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.7856 |
| logD: | 3.7808 |
| logSw: | -4.1915 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.992 |
| InChI Key: | AISRYLOGKJJWKA-UHFFFAOYSA-N |