1-butyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Chemical Structure Depiction of
1-butyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
1-butyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Compound characteristics
| Compound ID: | D021-0266 |
| Compound Name: | 1-butyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile |
| Molecular Weight: | 294.31 |
| Molecular Formula: | C16 H14 N4 O2 |
| Smiles: | CCCCN1C2=C(C=C(C#N)C1=O)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5511 |
| logD: | 1.5511 |
| logSw: | -1.3755 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.88 |
| InChI Key: | CLXLNKCGGJRLOC-UHFFFAOYSA-N |