(2,6-dibromo-4-{[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2,6-dibromo-4-{[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
(2,6-dibromo-4-{[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 2817-0768 |
| Compound Name: | (2,6-dibromo-4-{[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 558.18 |
| Molecular Formula: | C19 H11 Br2 F N2 O5 S |
| Smiles: | C(C(O)=O)Oc1c(cc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)F)=S)=O)cc1[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5054 |
| logD: | -0.7315 |
| logSw: | -3.8933 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.285 |
| InChI Key: | VEWCLEIZPLTUNU-UHFFFAOYSA-N |