N-[(4-fluorophenyl)methyl]-2-imino-10-methyl-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-imino-10-methyl-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
N-[(4-fluorophenyl)methyl]-2-imino-10-methyl-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y070-3052 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-imino-10-methyl-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C28 H32 F N5 O2 |
| Smiles: | CCCCCCCCN1C2=C(C=C(C1=N)C(NCc1ccc(cc1)F)=O)C(N1C=CC=C(C)C1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8517 |
| logD: | 4.7256 |
| logSw: | -4.5642 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.953 |
| InChI Key: | MJFDQDFLIMFLQY-UHFFFAOYSA-N |