3-({[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
3-({[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}methyl)benzonitrile
3-({[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | D692-0497 |
| Compound Name: | 3-({[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 383.43 |
| Molecular Formula: | C21 H13 N5 O S |
| Smiles: | C(c1cccc(C#N)c1)Sc1nnc2c3ccccc3nc(c3ccco3)n12 |
| Stereo: | ACHIRAL |
| logP: | 3.9863 |
| logD: | 3.9862 |
| logSw: | -4.3599 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.945 |
| InChI Key: | HPDHYZLDZLRJCL-UHFFFAOYSA-N |