3-(3-chlorophenyl)-7,7-dimethyl-1-(2-oxo-2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-7,7-dimethyl-1-(2-oxo-2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-(3-chlorophenyl)-7,7-dimethyl-1-(2-oxo-2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8640-0227 |
| Compound Name: | 3-(3-chlorophenyl)-7,7-dimethyl-1-(2-oxo-2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C25 H21 Cl N2 O4 S |
| Smiles: | CC1(C)Cc2c(CO1)c1c(C(N(C(N1CC(c1ccccc1)=O)=O)c1cccc(c1)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.8893 |
| logD: | 4.8893 |
| logSw: | -4.9284 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.695 |
| InChI Key: | RUCLMPUBLPQLMN-UHFFFAOYSA-N |