N-benzyl-2-imino-8-methyl-5-oxo-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-benzyl-2-imino-8-methyl-5-oxo-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
N-benzyl-2-imino-8-methyl-5-oxo-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | 5282-0348 |
| Compound Name: | N-benzyl-2-imino-8-methyl-5-oxo-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 450.5 |
| Molecular Formula: | C26 H22 N6 O2 |
| Smiles: | CC1C=CC2=NC3=C(C=C(C(=N)N3Cc3cccnc3)C(NCc3ccccc3)=O)C(N2C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7465 |
| logD: | 1.6513 |
| logSw: | -1.5324 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.719 |
| InChI Key: | NDZMDFXEKXOKCW-UHFFFAOYSA-N |