N-(4-chloro-2-methylphenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide
N-(4-chloro-2-methylphenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide
Compound characteristics
| Compound ID: | Y508-7513 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide |
| Molecular Weight: | 394.83 |
| Molecular Formula: | C16 H15 Cl N4 O4 S |
| Smiles: | Cc1cc(ccc1NC(CCC(N/N=C/c1ccc([N+]([O-])=O)s1)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2822 |
| logD: | 3.2818 |
| logSw: | -3.6777 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.544 |
| InChI Key: | VYSPSTZZLAAQJH-UHFFFAOYSA-N |