2-methylpropyl [5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]carbamate
Chemical Structure Depiction of
2-methylpropyl [5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]carbamate
2-methylpropyl [5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]carbamate
Compound characteristics
Compound ID: | 8007-7018 |
Compound Name: | 2-methylpropyl [5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]carbamate |
Molecular Weight: | 356.24 |
Molecular Formula: | C13 H14 Br N3 O2 S |
Smiles: | CC(C)COC(Nc1nnc(c2ccc(cc2)[Br])s1)=O |
Stereo: | ACHIRAL |
logP: | 4.8173 |
logD: | 4.8162 |
logSw: | -4.4582 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.331 |
InChI Key: | FWSBKNSGIJJGNV-UHFFFAOYSA-N |