7-acetyl-3-(3-acetylphenyl)-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)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-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)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-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C728-0379 |
| Compound Name: | 7-acetyl-3-(3-acetylphenyl)-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 541.59 |
| Molecular Formula: | C28 H23 N5 O5 S |
| Smiles: | CC(c1cccc(c1)N1C(c2c3CCN(Cc3sc2N(CC2=CC(N3C=CC=CC3=N2)=O)C1=O)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3645 |
| logD: | 1.3645 |
| logSw: | -2.3746 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.97 |
| InChI Key: | GPIFTXRWCMVDBM-UHFFFAOYSA-N |