4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-1,2-oxazol-5(4H)-one
4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 4285-2417 |
| Compound Name: | 4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 309.16 |
| Molecular Formula: | C13 H13 Br N2 O2 |
| Smiles: | CC1/C(=C\c2ccc(c(c2)[Br])N(C)C)C(=O)ON=1 |
| Stereo: | ACHIRAL |
| logP: | 2.7093 |
| logD: | 2.7093 |
| logSw: | -3.0299 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.64 |
| InChI Key: | AKHJNEPWXLXQSC-UHFFFAOYSA-N |