N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-[(tetrazolo[1,5-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-[(tetrazolo[1,5-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1)
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-[(tetrazolo[1,5-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C301-4492 |
| Compound Name: | N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-4-[(tetrazolo[1,5-a]quinoxalin-4-yl)amino]benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 572.11 |
| Molecular Formula: | C30 H33 N9 O |
| Salt: | HCl |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CCCNC(c2ccc(cc2)Nc2c3nnnn3c3ccccc3n2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3446 |
| logD: | 3.198 |
| logSw: | -4.1088 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.574 |
| InChI Key: | AJOOENMBYJRBHO-UHFFFAOYSA-N |