N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(3-methylbutyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(3-methylbutyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(3-methylbutyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
Compound characteristics
| Compound ID: | C741-1080 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(3-methylbutyl)-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide |
| Molecular Weight: | 491.59 |
| Molecular Formula: | C27 H33 N5 O4 |
| Smiles: | CC(C)CCN1C(c2ccccc2n2c(CCC(NCCc3ccc(c(c3)OC)OC)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1679 |
| logD: | 2.1679 |
| logSw: | -2.9034 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.53 |
| InChI Key: | TZRMPPTWQQWAQF-UHFFFAOYSA-N |