3-(benzenesulfonyl)-2-imino-8-methyl-1-(prop-2-en-1-yl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-2-imino-8-methyl-1-(prop-2-en-1-yl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
3-(benzenesulfonyl)-2-imino-8-methyl-1-(prop-2-en-1-yl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1884 |
| Compound Name: | 3-(benzenesulfonyl)-2-imino-8-methyl-1-(prop-2-en-1-yl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | CC1C=CC2=NC3=C(C=C(C(=N)N3CC=C)S(c3ccccc3)(=O)=O)C(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.048 |
| logD: | 1.8811 |
| logSw: | -2.5369 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.539 |
| InChI Key: | IITMYKWZHCOIOF-UHFFFAOYSA-N |