N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzene-1-sulfonamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y032-2443 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 410.86 |
| Molecular Formula: | C15 H11 Cl N4 O4 S2 |
| Smiles: | C(c1ccc(cc1)[Cl])c1nnc(NS(c2ccc(cc2)[N+]([O-])=O)(=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.83 |
| logD: | 0.3067 |
| logSw: | -4.4442 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.038 |
| InChI Key: | LXTFQATVFYADAB-UHFFFAOYSA-N |