butyl 3-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
Chemical Structure Depiction of
butyl 3-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
butyl 3-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | D083-0039 |
| Compound Name: | butyl 3-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C18 H23 N3 O3 |
| Smiles: | CCCCOC(c1cccc(c1)NC1NC(C=C(CCC)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4825 |
| logD: | 4.4371 |
| logSw: | -4.2853 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.011 |
| InChI Key: | RAKSMIAVHPOCSJ-UHFFFAOYSA-N |