N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1)
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C301-4491 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 573.1 |
| Molecular Formula: | C30 H32 N8 O2 |
| Salt: | HCl |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(c2ccc(cc2)Nc2c3nncn3c3ccccc3n2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.2678 |
| logD: | 2.724 |
| logSw: | -3.562 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.12 |
| InChI Key: | SPNBBEDEOYMZFL-UHFFFAOYSA-N |