N-[2-(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-(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-(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: | L244-0091 |
| Compound Name: | N-[2-(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: | 476.6 |
| Molecular Formula: | C25 H28 N6 O2 S |
| Smiles: | C1CCC2=C(C1)C(N1C(=N2)SC(=N1)N1CCCC(C1)C(NCCc1c[nH]c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9519 |
| logD: | 2.951 |
| logSw: | -3.1815 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.867 |
| InChI Key: | JOUGHZJHBOBADQ-KRWDZBQOSA-N |