7-chloro-4-nitro-5-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole
Chemical Structure Depiction of
7-chloro-4-nitro-5-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole
7-chloro-4-nitro-5-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole
Compound characteristics
| Compound ID: | R052-2774 |
| Compound Name: | 7-chloro-4-nitro-5-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole |
| Molecular Weight: | 268.66 |
| Molecular Formula: | C10 H9 Cl N4 O3 |
| Smiles: | C1CCN(C1)c1cc(c2c(c1[N+]([O-])=O)non2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4487 |
| logD: | 3.4487 |
| logSw: | -3.8351 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.396 |
| InChI Key: | KHYBAGRZSWCICT-UHFFFAOYSA-N |