7-{1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
7-{1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
7-{1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C887-1716 |
| Compound Name: | 7-{1-[4-(4-chlorophenyl)piperazin-1-yl]-1-oxobutan-2-yl}-5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 453.93 |
| Molecular Formula: | C23 H24 Cl N5 O3 |
| Smiles: | CCC(C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)N1C(c2cc3c(cco3)n2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7282 |
| logD: | 3.7282 |
| logSw: | -4.1369 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.146 |
| InChI Key: | NGKUPDHMTVFJKL-SFHVURJKSA-N |