ethyl 2-[(4-butoxybenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(4-butoxybenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-[(4-butoxybenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0731 |
| Compound Name: | ethyl 2-[(4-butoxybenzoyl)imino]-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 516.6 |
| Molecular Formula: | C29 H32 N4 O5 |
| Smiles: | CCCCOc1ccc(cc1)C(/N=C1\C(=CC2=C(N=C3C=CC=CN3C2=O)N1CC(C)C)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7609 |
| logD: | 4.7607 |
| logSw: | -4.3304 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.384 |
| InChI Key: | UCUQGCXIOOZAET-UHFFFAOYSA-N |