N-{[4-(dimethylamino)phenyl]methyl}-3-[(3-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-3-[(3-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-3-[(3-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K840-0481 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-3-[(3-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 530.62 |
| Molecular Formula: | C29 H27 F N4 O3 S |
| Smiles: | Cc1c2C(N(Cc3cccc(c3)F)C=Nc2sc1C(N(Cc1ccc(cc1)N(C)C)Cc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5398 |
| logD: | 4.5243 |
| logSw: | -4.5826 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.734 |
| InChI Key: | NOYBIBWBXUZFEQ-UHFFFAOYSA-N |