1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide
1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L245-0105 |
| Compound Name: | 1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 465.62 |
| Molecular Formula: | C25 H31 N5 O2 S |
| Smiles: | CC(CCc1ccccc1)NC(C1CCN(CC1)C1=NN2C(=NC3CCCCC=3C2=O)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6133 |
| logD: | 3.6126 |
| logSw: | -3.6484 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.663 |
| InChI Key: | CIBSNEKPPPCTPV-KRWDZBQOSA-N |