N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-methylbenzamide
N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | C301-7029 |
| Compound Name: | N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-methylbenzamide |
| Molecular Weight: | 534.06 |
| Molecular Formula: | C29 H31 N5 O3 |
| Salt: | HCl |
| Smiles: | CCOc1ccc(cc1)Nc1c(c(C)nc(Nc2ccc(cc2)OCC)n1)NC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2055 |
| logD: | 6.1107 |
| logSw: | -5.5446 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.928 |
| InChI Key: | FMUBJPCZHLHGTG-UHFFFAOYSA-N |