2-(2-anilino-2-oxoethyl)-N-(butan-2-yl)-4-cyclopropyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-(2-anilino-2-oxoethyl)-N-(butan-2-yl)-4-cyclopropyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
2-(2-anilino-2-oxoethyl)-N-(butan-2-yl)-4-cyclopropyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
Compound ID: | F470-1073 |
Compound Name: | 2-(2-anilino-2-oxoethyl)-N-(butan-2-yl)-4-cyclopropyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
Molecular Weight: | 474.52 |
Molecular Formula: | C25 H26 N6 O4 |
Smiles: | CCC(C)NC(c1ccc2C(N(C3CC3)C3=NN(CC(Nc4ccccc4)=O)C(N3c2c1)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.19 |
logD: | 2.19 |
logSw: | -3.2278 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.764 |
InChI Key: | YTZBMNJOSSYDRJ-HNNXBMFYSA-N |