N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Chemical Structure Depiction of
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | Y042-4487 |
| Compound Name: | N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C20 H23 N5 O3 S |
| Smiles: | CCN1C(c2ccccc2N2C(CCC12C(Nc1nnc(C(C)(C)C)s1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7856 |
| logD: | 2.489 |
| logSw: | -3.5855 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.744 |
| InChI Key: | VSTUDQJZGRZZCI-HXUWFJFHSA-N |