1-{4-[3-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
1-{4-[3-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V001-3465 |
| Compound Name: | 1-{4-[3-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C23 H20 N6 O2 S |
| Salt: | not_available |
| Smiles: | C(C(N1CCN(CC1)c1nc2ccccc2c2nnc(c3ccco3)n12)=O)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 3.0876 |
| logD: | 3.0811 |
| logSw: | -3.0485 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.519 |
| InChI Key: | XJJHQQQPNJYASQ-UHFFFAOYSA-N |