3-(benzenesulfonyl)-1-[(furan-2-yl)methyl]-2-imino-8-methyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-1-[(furan-2-yl)methyl]-2-imino-8-methyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
3-(benzenesulfonyl)-1-[(furan-2-yl)methyl]-2-imino-8-methyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1866 |
| Compound Name: | 3-(benzenesulfonyl)-1-[(furan-2-yl)methyl]-2-imino-8-methyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 446.48 |
| Molecular Formula: | C23 H18 N4 O4 S |
| Smiles: | CC1C=CC2=NC3=C(C=C(C(=N)N3Cc3ccco3)S(c3ccccc3)(=O)=O)C(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4175 |
| logD: | 1.8105 |
| logSw: | -2.7305 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.038 |
| InChI Key: | MDZXNGSQWBAQAK-UHFFFAOYSA-N |