3-(4-chlorophenyl)-1-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
3-(4-chlorophenyl)-1-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C258-0669 |
| Compound Name: | 3-(4-chlorophenyl)-1-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 467.93 |
| Molecular Formula: | C23 H18 Cl N3 O4 S |
| Smiles: | C1CCc2c(C1)c1C(N(C(N(Cc3cccc(c3)[N+]([O-])=O)c1s2)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5136 |
| logD: | 5.5136 |
| logSw: | -6.237 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.409 |
| InChI Key: | ZBMOVHREINNERQ-UHFFFAOYSA-N |