N-(4-bromophenyl)-2-{[5-(tert-butylcarbamamido)-1,3,4-thiadiazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-{[5-(tert-butylcarbamamido)-1,3,4-thiadiazol-2-yl]sulfanyl}acetamide
N-(4-bromophenyl)-2-{[5-(tert-butylcarbamamido)-1,3,4-thiadiazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-9905 |
| Compound Name: | N-(4-bromophenyl)-2-{[5-(tert-butylcarbamamido)-1,3,4-thiadiazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 444.37 |
| Molecular Formula: | C15 H18 Br N5 O2 S2 |
| Smiles: | CC(C)(C)NC(Nc1nnc(SCC(Nc2ccc(cc2)[Br])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5978 |
| logD: | 4.5977 |
| logSw: | -4.3181 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.743 |
| InChI Key: | FRGFXCAUWQHPMD-UHFFFAOYSA-N |