2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}-N-[3-(morpholin-4-yl)propyl]hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}-N-[3-(morpholin-4-yl)propyl]hydrazine-1-carbothioamide
2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}-N-[3-(morpholin-4-yl)propyl]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-5918 |
| Compound Name: | 2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}-N-[3-(morpholin-4-yl)propyl]hydrazine-1-carbothioamide |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C23 H29 N5 O5 S |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)OCc1cccc(c1)C(NNC(NCCCN1CCOCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2328 |
| logD: | 2.2328 |
| logSw: | -2.8044 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.616 |
| InChI Key: | GNLFAYZWXPUVCJ-UHFFFAOYSA-N |