1-cyclopentyl-2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Chemical Structure Depiction of
1-cyclopentyl-2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
1-cyclopentyl-2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one
Compound characteristics
| Compound ID: | 5611-1959 |
| Compound Name: | 1-cyclopentyl-2-imino-8-methyl-3-(4-methylbenzene-1-sulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | CC1C=CC2=NC3=C(C=C(C(=N)N3C3CCCC3)S(c3ccc(C)cc3)(=O)=O)C(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1919 |
| logD: | 3.1721 |
| logSw: | -3.5198 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.876 |
| InChI Key: | MCRZQBKFGLDKRK-UHFFFAOYSA-N |