N-(3,4-dimethoxyphenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propanamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propanamide
N-(3,4-dimethoxyphenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | J084-0165 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propanamide |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C26 H23 N5 O3 S |
| Smiles: | CC(C(Nc1ccc(c(c1)OC)OC)=O)Sc1nnc2c3ccccc3nc(c3ccccc3)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7222 |
| logD: | 4.7143 |
| logSw: | -4.8065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.934 |
| InChI Key: | CNIVLUSHUOEPMP-INIZCTEOSA-N |