N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-nitrobenzamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-nitrobenzamide
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3364 |
| Compound Name: | N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-nitrobenzamide |
| Molecular Weight: | 390.8 |
| Molecular Formula: | C16 H11 Cl N4 O4 S |
| Smiles: | C(c1nnc(NC(c2ccccc2[N+]([O-])=O)=O)s1)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.831 |
| logD: | 0.4423 |
| logSw: | -4.593 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.678 |
| InChI Key: | FVUOQYHETHPMGT-UHFFFAOYSA-N |