N-[2-(5-methyl-1H-indol-3-yl)ethyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-3-carboxamide
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | L244-0136 |
| Compound Name: | N-[2-(5-methyl-1H-indol-3-yl)ethyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-3-carboxamide |
| Molecular Weight: | 490.63 |
| Molecular Formula: | C26 H30 N6 O2 S |
| Smiles: | Cc1ccc2c(c1)c(CCNC(C1CCCN(C1)C1=NN3C(=NC4CCCCC=4C3=O)S1)=O)c[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4004 |
| logD: | 3.3995 |
| logSw: | -3.6183 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.867 |
| InChI Key: | JEPOBDMXFCYXSB-SFHVURJKSA-N |