3-benzyl-1-[(4-nitrophenyl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
3-benzyl-1-[(4-nitrophenyl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-benzyl-1-[(4-nitrophenyl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C258-0445 |
| Compound Name: | 3-benzyl-1-[(4-nitrophenyl)methyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C23 H19 N3 O4 S |
| Smiles: | C1Cc2c3C(N(Cc4ccccc4)C(N(Cc4ccc(cc4)[N+]([O-])=O)c3sc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2722 |
| logD: | 5.2722 |
| logSw: | -5.4658 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.386 |
| InChI Key: | BMUJJWANJGOOTA-UHFFFAOYSA-N |