N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Chemical Structure Depiction of
N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Compound characteristics
| Compound ID: | C046-0267 |
| Compound Name: | N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide |
| Molecular Weight: | 502.68 |
| Molecular Formula: | C25 H38 N6 O3 S |
| Smiles: | CCN1CCN(CCCNC(CCCNC(CN2C=Nc3c(C2=O)c2CCCCc2s3)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | -0.0331 |
| logD: | -0.9813 |
| logSw: | -1.6366 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.307 |
| InChI Key: | SGJWRZQVNLWYIR-UHFFFAOYSA-N |