N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-imino-1-[(4-methylphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-imino-1-[(4-methylphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-imino-1-[(4-methylphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y070-2628 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-imino-1-[(4-methylphenyl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 493.52 |
| Molecular Formula: | C28 H23 N5 O4 |
| Smiles: | Cc1ccc(CN2C3=C(C=C(C2=N)C(NCc2ccc4c(c2)OCO4)=O)C(N2C=CC=CC2=N3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.092 |
| logD: | 3.0314 |
| logSw: | -3.2114 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.798 |
| InChI Key: | RYKXTCAFPCSSED-UHFFFAOYSA-N |