N-[(2-chlorophenyl)methyl]-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
N-[(2-chlorophenyl)methyl]-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y070-2686 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-imino-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 492.02 |
| Molecular Formula: | C27 H30 Cl N5 O2 |
| Smiles: | CCCCCCCCN1C2=C(C=C(C1=N)C(NCc1ccccc1[Cl])=O)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3343 |
| logD: | 5.2763 |
| logSw: | -5.7395 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.932 |
| InChI Key: | ZANINBDOIKKVDZ-UHFFFAOYSA-N |