2,5-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
2,5-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
2,5-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C785-3742 |
| Compound Name: | 2,5-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C24 H27 N5 O2 S |
| Smiles: | CCC1=NN(CC(N2CCN(CC2)c2ccccc2)=O)C(c2cc3c(cc(CC)s3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5504 |
| logD: | 3.5503 |
| logSw: | -3.6672 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.139 |
| InChI Key: | MNLLEPGTSSABOM-UHFFFAOYSA-N |