4-amino-N-[2-(3-bromobenzamido)ethyl]-1,2,5-oxadiazole-3-carboxamide
Chemical Structure Depiction of
4-amino-N-[2-(3-bromobenzamido)ethyl]-1,2,5-oxadiazole-3-carboxamide
4-amino-N-[2-(3-bromobenzamido)ethyl]-1,2,5-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | 2023-0596 |
| Compound Name: | 4-amino-N-[2-(3-bromobenzamido)ethyl]-1,2,5-oxadiazole-3-carboxamide |
| Molecular Weight: | 354.16 |
| Molecular Formula: | C12 H12 Br N5 O3 |
| Smiles: | C(CNC(c1c(N)non1)=O)NC(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9247 |
| logD: | 0.9247 |
| logSw: | -1.9674 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 106.105 |
| InChI Key: | MDAGDZVQBSORTO-UHFFFAOYSA-N |