N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-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-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-4-carboxamide
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-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: | L245-0130 |
| Compound Name: | N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-(5-oxo-6,7,8,9-tetrahydro-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 456.57 |
| Molecular Formula: | C22 H28 N6 O3 S |
| Smiles: | Cc1c(CCNC(C2CCN(CC2)C2=NN3C(=NC4CCCCC=4C3=O)S2)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.8388 |
| logD: | 1.8381 |
| logSw: | -2.297 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.101 |
| InChI Key: | METCABRXPCBCED-UHFFFAOYSA-N |