5-methyl-7-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
5-methyl-7-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
5-methyl-7-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C785-1114 |
| Compound Name: | 5-methyl-7-[1-oxo-1-(4-phenylpiperazin-1-yl)butan-2-yl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 435.55 |
| Molecular Formula: | C23 H25 N5 O2 S |
| Smiles: | CCC(C(N1CCN(CC1)c1ccccc1)=O)N1C(c2cc3c(ccs3)n2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6361 |
| logD: | 3.6361 |
| logSw: | -3.831 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.692 |
| InChI Key: | MPBALNMNYKHZOK-SFHVURJKSA-N |