ethyl 1-cyclohexyl-2-[(2-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-cyclohexyl-2-[(2-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 1-cyclohexyl-2-[(2-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0501 |
| Compound Name: | ethyl 1-cyclohexyl-2-[(2-nitrobenzoyl)imino]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 515.53 |
| Molecular Formula: | C27 H25 N5 O6 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(C2CCCCC2)C\1=N/C(c1ccccc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1815 |
| logD: | 3.1815 |
| logSw: | -3.6815 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 101.996 |
| InChI Key: | PELMDWRXPCOPKF-UHFFFAOYSA-N |