2-({[4-(1,3-benzothiazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
Chemical Structure Depiction of
2-({[4-(1,3-benzothiazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
2-({[4-(1,3-benzothiazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
Compound characteristics
| Compound ID: | 8005-7947 |
| Compound Name: | 2-({[4-(1,3-benzothiazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol |
| Molecular Weight: | 437.9 |
| Molecular Formula: | C22 H16 Cl N3 O3 S |
| Smiles: | Cc1c(/C=N/c2ccc(cc2)c2nc3ccccc3s2)c(c(c(C)c1[Cl])[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 6.7063 |
| logD: | 4.9263 |
| logSw: | -6.1978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.074 |
| InChI Key: | RQYFPRUDFYKMSD-UHFFFAOYSA-N |