2-imino-1-(3-methoxypropyl)-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
2-imino-1-(3-methoxypropyl)-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
2-imino-1-(3-methoxypropyl)-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1975 |
| Compound Name: | 2-imino-1-(3-methoxypropyl)-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | Cc1ccc(cc1)S(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CCCOC)C1=N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0605 |
| logD: | 1.8816 |
| logSw: | -2.7034 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.362 |
| InChI Key: | IRRLRKFXFWYNJK-UHFFFAOYSA-N |