2-{2-[benzyl(methyl)amino]-4-(3-methylphenoxy)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl}benzonitrile
Chemical Structure Depiction of
2-{2-[benzyl(methyl)amino]-4-(3-methylphenoxy)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl}benzonitrile
2-{2-[benzyl(methyl)amino]-4-(3-methylphenoxy)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | V020-9416 |
| Compound Name: | 2-{2-[benzyl(methyl)amino]-4-(3-methylphenoxy)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl}benzonitrile |
| Molecular Weight: | 525.63 |
| Molecular Formula: | C29 H27 N5 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)Oc1c2CN(CCc2nc(n1)N(C)Cc1ccccc1)S(c1ccccc1C#N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9849 |
| logD: | 5.9849 |
| logSw: | -5.6878 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.126 |
| InChI Key: | XKESSNVUGVNDJY-UHFFFAOYSA-N |