10-methyl-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Chemical Structure Depiction of
10-methyl-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
10-methyl-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Compound characteristics
| Compound ID: | D021-0074 |
| Compound Name: | 10-methyl-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile |
| Molecular Weight: | 396.33 |
| Molecular Formula: | C20 H11 F3 N4 O2 |
| Smiles: | CC1=CC=CN2C1=NC1=C(C=C(C#N)C(N1c1cccc(c1)C(F)(F)F)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.6075 |
| logD: | 2.6074 |
| logSw: | -2.8122 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.039 |
| InChI Key: | NQTCSHWCYVYLPL-UHFFFAOYSA-N |