N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
Compound characteristics
| Compound ID: | Y021-1774 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine |
| Molecular Weight: | 421.4 |
| Molecular Formula: | C18 H14 F3 N5 O2 S |
| Smiles: | C1COc2cc(ccc2O1)NC(=N)Nc1nc(cc(C(F)(F)F)n1)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.1359 |
| logD: | 0.2961 |
| logSw: | -4.359 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.12 |
| InChI Key: | YYGNKLXGBGTDHA-UHFFFAOYSA-N |