1-[(4-chlorophenyl)methyl]-2-imino-5-oxo-N-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-2-imino-5-oxo-N-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
1-[(4-chlorophenyl)methyl]-2-imino-5-oxo-N-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y070-4836 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-2-imino-5-oxo-N-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 419.87 |
| Molecular Formula: | C22 H18 Cl N5 O2 |
| Smiles: | C=CCNC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(Cc2ccc(cc2)[Cl])C1=N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1799 |
| logD: | 2.1144 |
| logSw: | -3.1306 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.795 |
| InChI Key: | YGDCTVVBXXRHRK-UHFFFAOYSA-N |