2-imino-N-[(4-methoxyphenyl)methyl]-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
2-imino-N-[(4-methoxyphenyl)methyl]-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
2-imino-N-[(4-methoxyphenyl)methyl]-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y070-2521 |
| Compound Name: | 2-imino-N-[(4-methoxyphenyl)methyl]-1-octyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C28 H33 N5 O3 |
| Smiles: | CCCCCCCCN1C2=C(C=C(C1=N)C(NCc1ccc(cc1)OC)=O)C(N1C=CC=CC1=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5346 |
| logD: | 4.5184 |
| logSw: | -4.3311 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.476 |
| InChI Key: | AXCHQWSZVFBZMZ-UHFFFAOYSA-N |