4-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzene-1-sulfonamide
4-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y030-6953 |
| Compound Name: | 4-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}benzene-1-sulfonamide |
| Molecular Weight: | 440.34 |
| Molecular Formula: | C16 H14 Br N3 O3 S2 |
| Smiles: | COc1ccc(Cc2nnc(NS(c3ccc(cc3)[Br])(=O)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1259 |
| logD: | 1.2951 |
| logSw: | -4.3006 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.2 |
| InChI Key: | KCEMLRILFCPYGD-UHFFFAOYSA-N |