N-(3-chloro-4-fluorophenyl)-N'-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N'-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea
N-(3-chloro-4-fluorophenyl)-N'-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea
Compound characteristics
Compound ID: | E569-0013 |
Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-[(5-methyl-1,2-benzoxazol-3-yl)methyl]urea |
Molecular Weight: | 333.75 |
Molecular Formula: | C16 H13 Cl F N3 O2 |
Smiles: | Cc1ccc2c(c1)c(CNC(Nc1ccc(c(c1)[Cl])F)=O)no2 |
Stereo: | ACHIRAL |
logP: | 4.2988 |
logD: | 4.2982 |
logSw: | -4.4992 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.558 |
InChI Key: | HPMIIRXPZDBYPW-UHFFFAOYSA-N |