7-chloro-4-nitro-N-(4-phenoxyphenyl)-2,1,3-benzoxadiazol-5-amine
Chemical Structure Depiction of
7-chloro-4-nitro-N-(4-phenoxyphenyl)-2,1,3-benzoxadiazol-5-amine
7-chloro-4-nitro-N-(4-phenoxyphenyl)-2,1,3-benzoxadiazol-5-amine
Compound characteristics
| Compound ID: | 4061-0085 |
| Compound Name: | 7-chloro-4-nitro-N-(4-phenoxyphenyl)-2,1,3-benzoxadiazol-5-amine |
| Molecular Weight: | 382.76 |
| Molecular Formula: | C18 H11 Cl N4 O4 |
| Smiles: | c1ccc(cc1)Oc1ccc(cc1)Nc1cc(c2c(c1[N+]([O-])=O)non2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.3676 |
| logD: | 6.3676 |
| logSw: | -6.4904 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.841 |
| InChI Key: | DTKADFSHXOXLMW-UHFFFAOYSA-N |