3-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}-5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
3-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}-5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
3-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}-5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | J084-0821 |
| Compound Name: | 3-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}-5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 415.52 |
| Molecular Formula: | C23 H21 N5 O S |
| Smiles: | Cc1ccc(cc1)c1nc2ccccc2c2nnc(n12)SCCc1c(C)noc1C |
| Stereo: | ACHIRAL |
| logP: | 5.2344 |
| logD: | 5.1257 |
| logSw: | -5.3793 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.348 |
| InChI Key: | WOSLKDXYFLMDKQ-UHFFFAOYSA-N |