N-cyclopentyl-2-[2-(2,5-difluoroanilino)-2-oxoethyl]-4-methyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-2-[2-(2,5-difluoroanilino)-2-oxoethyl]-4-methyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
N-cyclopentyl-2-[2-(2,5-difluoroanilino)-2-oxoethyl]-4-methyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | F470-0764 |
| Compound Name: | N-cyclopentyl-2-[2-(2,5-difluoroanilino)-2-oxoethyl]-4-methyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
| Molecular Weight: | 496.47 |
| Molecular Formula: | C24 H22 F2 N6 O4 |
| Smiles: | CN1C2=NN(CC(Nc3cc(ccc3F)F)=O)C(N2c2cc(ccc2C1=O)C(NC1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3522 |
| logD: | 2.3486 |
| logSw: | -3.1704 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.929 |
| InChI Key: | PDKCQVFWVITVTP-UHFFFAOYSA-N |