methyl 4-[(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazole-5-carbonyl]amino}ethyl)carbamoyl]benzoate
Chemical Structure Depiction of
methyl 4-[(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazole-5-carbonyl]amino}ethyl)carbamoyl]benzoate
methyl 4-[(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazole-5-carbonyl]amino}ethyl)carbamoyl]benzoate
Compound characteristics
| Compound ID: | 8018-9967 |
| Compound Name: | methyl 4-[(2-{[3-(5-bromofuran-2-yl)-1,2,4-oxadiazole-5-carbonyl]amino}ethyl)carbamoyl]benzoate |
| Molecular Weight: | 463.24 |
| Molecular Formula: | C18 H15 Br N4 O6 |
| Smiles: | COC(c1ccc(cc1)C(NCCNC(c1nc(c2ccc(o2)[Br])no1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9546 |
| logD: | 1.9546 |
| logSw: | -2.373 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.797 |
| InChI Key: | PTACRCGNRKSDAG-UHFFFAOYSA-N |