N-[(4-ethylphenyl)methyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-4-carboxamide
N-[(4-ethylphenyl)methyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C796-1346 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C24 H29 N5 O2 S |
| Smiles: | CCc1ccc(CNC(C2CCN(CC2)C2=NN3C(=NC4CCCCC=4C3=O)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3641 |
| logD: | 3.3634 |
| logSw: | -3.3226 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.222 |
| InChI Key: | IENQYWLGPMSXTE-UHFFFAOYSA-N |