6-(morpholin-4-yl)-N~2~-(4-nitrophenyl)-N~4~-(prop-2-en-1-yl)-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
6-(morpholin-4-yl)-N~2~-(4-nitrophenyl)-N~4~-(prop-2-en-1-yl)-1,3,5-triazine-2,4-diamine
6-(morpholin-4-yl)-N~2~-(4-nitrophenyl)-N~4~-(prop-2-en-1-yl)-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | K890-0058 |
| Compound Name: | 6-(morpholin-4-yl)-N~2~-(4-nitrophenyl)-N~4~-(prop-2-en-1-yl)-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 357.37 |
| Molecular Formula: | C16 H19 N7 O3 |
| Smiles: | C=CCNc1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(n1)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6972 |
| logD: | 3.6965 |
| logSw: | -4.0225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.303 |
| InChI Key: | PELJSSCGEXJRFZ-UHFFFAOYSA-N |