7-{4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
7-{4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
7-{4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C887-1440 |
| Compound Name: | 7-{4-[4-(4-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 467.95 |
| Molecular Formula: | C24 H26 Cl N5 O3 |
| Smiles: | CCC1=NN(CCCC(N2CCN(CC2)c2ccc(cc2)[Cl])=O)C(c2cc3c(cco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9402 |
| logD: | 2.9367 |
| logSw: | -3.3641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.571 |
| InChI Key: | PQYZTIRKYIWTGJ-UHFFFAOYSA-N |