N-cyclopentyl-2-[2-(2,4-dimethylphenyl)-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-(2,4-dimethylphenyl)-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-(2,4-dimethylphenyl)-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: | F471-0759 |
| Compound Name: | N-cyclopentyl-2-[2-(2,4-dimethylphenyl)-2-oxoethyl]-4-methyl-1,5-dioxo-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C26 H27 N5 O4 |
| Smiles: | Cc1ccc(C(CN2C(N3C(=N2)N(C)C(c2ccc(cc23)C(NC2CCCC2)=O)=O)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1431 |
| logD: | 3.1431 |
| logSw: | -3.3916 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.724 |
| InChI Key: | YQMNIVXRTVVUNB-UHFFFAOYSA-N |