3-({7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol
Chemical Structure Depiction of
3-({7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol
3-({7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol
Compound characteristics
| Compound ID: | K901-0911 |
| Compound Name: | 3-({7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol |
| Molecular Weight: | 426.47 |
| Molecular Formula: | C21 H26 N6 O4 |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)c1cc(c(c2c1non2)[N+]([O-])=O)NCCCO |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9983 |
| logD: | 3.9983 |
| logSw: | -4.2463 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.814 |
| InChI Key: | GNXSJNJLQKEULP-HNNXBMFYSA-N |