N-[(oxolan-2-yl)methyl]-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
N-[(oxolan-2-yl)methyl]-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | J084-0037 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C22 H21 N5 O2 S |
| Smiles: | C1CC(CNC(CSc2nnc3c4ccccc4nc(c4ccccc4)n23)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.892 |
| logD: | 2.8866 |
| logSw: | -3.1656 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.436 |
| InChI Key: | LZZTYVCLHXDCFM-MRXNPFEDSA-N |