2-[2-(benzylamino)-2-oxoethyl]-N-cyclopentyl-1,5-dioxo-4-(propan-2-yl)-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-[2-(benzylamino)-2-oxoethyl]-N-cyclopentyl-1,5-dioxo-4-(propan-2-yl)-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
2-[2-(benzylamino)-2-oxoethyl]-N-cyclopentyl-1,5-dioxo-4-(propan-2-yl)-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | F470-0899 |
| Compound Name: | 2-[2-(benzylamino)-2-oxoethyl]-N-cyclopentyl-1,5-dioxo-4-(propan-2-yl)-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
| Molecular Weight: | 502.57 |
| Molecular Formula: | C27 H30 N6 O4 |
| Smiles: | CC(C)N1C2=NN(CC(NCc3ccccc3)=O)C(N2c2cc(ccc2C1=O)C(NC1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7775 |
| logD: | 2.7775 |
| logSw: | -3.5743 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.904 |
| InChI Key: | WNKGTVRWFDTBRB-UHFFFAOYSA-N |