N~4~-(3-fluorophenyl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~4~-(3-fluorophenyl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine
N~4~-(3-fluorophenyl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine
Compound characteristics
| Compound ID: | G786-0226 |
| Compound Name: | N~4~-(3-fluorophenyl)-5-nitro-N~2~-(prop-2-en-1-yl)pyrimidine-2,4,6-triamine |
| Molecular Weight: | 304.28 |
| Molecular Formula: | C13 H13 F N6 O2 |
| Smiles: | C=CCNc1nc(c(c(Nc2cccc(c2)F)n1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 2.8974 |
| logD: | 2.8973 |
| logSw: | -3.3892 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 93.32 |
| InChI Key: | QVHQZXTUQOCCFM-UHFFFAOYSA-N |