2-[(4-bromoanilino)methyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[(4-bromoanilino)methyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
2-[(4-bromoanilino)methyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8576-1351 |
| Compound Name: | 2-[(4-bromoanilino)methyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 426.33 |
| Molecular Formula: | C20 H16 Br N3 O S |
| Smiles: | Cc1c(c2ccccc2)c2C(NC(CNc3ccc(cc3)[Br])=Nc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.196 |
| logD: | 5.196 |
| logSw: | -5.1951 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.037 |
| InChI Key: | ADFXAJIQASWOHO-UHFFFAOYSA-N |