N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-tert-butylbenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-tert-butylbenzamide--hydrogen chloride (1/1)
N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-tert-butylbenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C301-7126 |
| Compound Name: | N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-4-tert-butylbenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 576.14 |
| Molecular Formula: | C32 H37 N5 O3 |
| Salt: | HCl |
| Smiles: | CCOc1ccc(cc1)Nc1c(c(C)nc(Nc2ccc(cc2)OCC)n1)NC(c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5766 |
| logD: | 7.4818 |
| logSw: | -5.7316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.928 |
| InChI Key: | PXVCOUOZMIOIAV-UHFFFAOYSA-N |