4-amino-N-(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide
Chemical Structure Depiction of
4-amino-N-(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide
4-amino-N-(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | D272-0055 |
| Compound Name: | 4-amino-N-(2-{[(5-bromo-2-methoxyphenyl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide |
| Molecular Weight: | 406.66 |
| Molecular Formula: | C13 H16 Br N5 O3 |
| Salt: | HCl |
| Smiles: | [H]N(CCNC(c1c(N)non1)=O)Cc1cc(ccc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.1348 |
| logD: | 0.0753 |
| logSw: | -2.1395 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.088 |
| InChI Key: | ZYLOHSWMNQSNDQ-UHFFFAOYSA-N |