4-amino-N-{2-[({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-amino-N-{2-[({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1)
4-amino-N-{2-[({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8104-05022 |
| Compound Name: | 4-amino-N-{2-[({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 418.28 |
| Molecular Formula: | C16 H20 Cl N5 O4 |
| Salt: | HCl |
| Smiles: | [H]N(CCNC(c1c(N)non1)=O)Cc1cc(c(c(c1)[Cl])OCC=C)OC |
| Stereo: | ACHIRAL |
| logP: | 1.5076 |
| logD: | -0.3106 |
| logSw: | -2.6756 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 108.678 |
| InChI Key: | PUMXKVABJXFXOB-UHFFFAOYSA-N |