8-chloro-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
8-chloro-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
8-chloro-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F366-0401 |
| Compound Name: | 8-chloro-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]-4-propyl-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 424.89 |
| Molecular Formula: | C22 H21 Cl N4 O3 |
| Smiles: | CCCN1C2=NN(CC(c3cc(C)ccc3C)=O)C(N2c2cc(ccc2C1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2336 |
| logD: | 4.2336 |
| logSw: | -4.489 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.432 |
| InChI Key: | UQKGWVJJFJIBHC-UHFFFAOYSA-N |