2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-[(4-methylphenyl)methyl]acetamide
2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C688-1120 |
| Compound Name: | 2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C27 H23 N3 O3 S |
| Smiles: | Cc1ccc(CNC(CN2C(N(Cc3ccccc3)C(c3c2c2ccccc2s3)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2058 |
| logD: | 5.2058 |
| logSw: | -5.233 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.642 |
| InChI Key: | HKVIGEXSTCSUPM-UHFFFAOYSA-N |