N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-3,4,5-triethoxybenzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-3,4,5-triethoxybenzamide--hydrogen chloride (1/1)
N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-3,4,5-triethoxybenzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C301-7129 |
| Compound Name: | N-[2,4-bis(4-ethoxyanilino)-6-methylpyrimidin-5-yl]-3,4,5-triethoxybenzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 652.19 |
| Molecular Formula: | C34 H41 N5 O6 |
| Salt: | HCl |
| Smiles: | CCOc1ccc(cc1)Nc1c(c(C)nc(Nc2ccc(cc2)OCC)n1)NC(c1cc(c(c(c1)OCC)OCC)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5217 |
| logD: | 6.4317 |
| logSw: | -5.6048 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.646 |
| InChI Key: | XQHVEODKFOMYRZ-UHFFFAOYSA-N |