2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1878 |
| Compound Name: | 2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C24 H24 N4 O4 S |
| Smiles: | CC1C=CC2=NC3=C(C=C(C(=N)N3CC3CCCO3)S(c3ccc(C)cc3)(=O)=O)C(N2C=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2153 |
| logD: | 2.1755 |
| logSw: | -2.7206 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.943 |
| InChI Key: | LSCNQNQKIOEJPP-QGZVFWFLSA-N |