N-(3-chloro-4-methylphenyl)-2-[4-(morpholin-4-yl)-3-nitrobenzoyl]hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[4-(morpholin-4-yl)-3-nitrobenzoyl]hydrazine-1-carbothioamide
N-(3-chloro-4-methylphenyl)-2-[4-(morpholin-4-yl)-3-nitrobenzoyl]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K781-1899 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[4-(morpholin-4-yl)-3-nitrobenzoyl]hydrazine-1-carbothioamide |
| Molecular Weight: | 449.91 |
| Molecular Formula: | C19 H20 Cl N5 O4 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(NNC(c1ccc(c(c1)[N+]([O-])=O)N1CCOCC1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.7603 |
| logD: | 2.8616 |
| logSw: | -4.2694 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.307 |
| InChI Key: | QMRVKGWGWGFQRD-UHFFFAOYSA-N |