methyl 1-(3-hydroxypropyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
methyl 1-(3-hydroxypropyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
methyl 1-(3-hydroxypropyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | 5655-0064 |
| Compound Name: | methyl 1-(3-hydroxypropyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 328.33 |
| Molecular Formula: | C16 H16 N4 O4 |
| Smiles: | COC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(CCCO)C1=N)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1669 |
| logD: | -0.3282 |
| logSw: | -0.5841 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.348 |
| InChI Key: | IIIPNMLAJIDMAB-UHFFFAOYSA-N |