N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-N'-(2-nitrophenyl)urea
Chemical Structure Depiction of
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-N'-(2-nitrophenyl)urea
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-N'-(2-nitrophenyl)urea
Compound characteristics
Compound ID: | C301-6869 |
Compound Name: | N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-ethyl-N'-(2-nitrophenyl)urea |
Molecular Weight: | 447.31 |
Molecular Formula: | C18 H15 Br N4 O3 S |
Smiles: | CCN(C(Nc1ccccc1[N+]([O-])=O)=O)c1nc(cs1)c1ccc(cc1)[Br] |
Stereo: | ACHIRAL |
logP: | 6.3946 |
logD: | 6.3945 |
logSw: | -5.7319 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.338 |
InChI Key: | UDJBVFOGLUGUJY-UHFFFAOYSA-N |