N-(3-bromophenyl)-4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide
Chemical Structure Depiction of
N-(3-bromophenyl)-4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide
N-(3-bromophenyl)-4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide
Compound characteristics
Compound ID: | 8004-0202 |
Compound Name: | N-(3-bromophenyl)-4-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide |
Molecular Weight: | 419.23 |
Molecular Formula: | C17 H15 Br N4 O4 |
Smiles: | C(CC(N/N=C/c1cccc(c1)[N+]([O-])=O)=O)C(Nc1cccc(c1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 2.9997 |
logD: | 2.999 |
logSw: | -3.3691 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.872 |
InChI Key: | CXJIFOZAALXNCU-UHFFFAOYSA-N |