butyl 4-[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
Chemical Structure Depiction of
butyl 4-[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
butyl 4-[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | D306-1221 |
| Compound Name: | butyl 4-[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)amino]benzoate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C21 H21 N3 O3 |
| Smiles: | CCCCOC(c1ccc(cc1)NC1NC(C=C(c2ccccc2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5879 |
| logD: | 4.5725 |
| logSw: | -4.3774 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.634 |
| InChI Key: | BADOQNBEQJKFDA-UHFFFAOYSA-N |