7-acetyl-3-(3-acetylphenyl)-1-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-acetyl-3-(3-acetylphenyl)-1-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
7-acetyl-3-(3-acetylphenyl)-1-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C728-0409 |
| Compound Name: | 7-acetyl-3-(3-acetylphenyl)-1-[(3-chlorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 507.99 |
| Molecular Formula: | C26 H22 Cl N3 O4 S |
| Smiles: | CC(c1cccc(c1)N1C(c2c3CCN(Cc3sc2N(Cc2cccc(c2)[Cl])C1=O)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7512 |
| logD: | 3.7512 |
| logSw: | -4.5705 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.983 |
| InChI Key: | RBEYTUBEIPQFDA-UHFFFAOYSA-N |