N'-(3,5-dimethoxybenzoyl)-4-{[(3-fluorophenyl)methyl]sulfanyl}-3-nitrobenzohydrazide
Chemical Structure Depiction of
N'-(3,5-dimethoxybenzoyl)-4-{[(3-fluorophenyl)methyl]sulfanyl}-3-nitrobenzohydrazide
N'-(3,5-dimethoxybenzoyl)-4-{[(3-fluorophenyl)methyl]sulfanyl}-3-nitrobenzohydrazide
Compound characteristics
| Compound ID: | K781-2725 |
| Compound Name: | N'-(3,5-dimethoxybenzoyl)-4-{[(3-fluorophenyl)methyl]sulfanyl}-3-nitrobenzohydrazide |
| Molecular Weight: | 485.49 |
| Molecular Formula: | C23 H20 F N3 O6 S |
| Smiles: | COc1cc(cc(c1)OC)C(NNC(c1ccc(c(c1)[N+]([O-])=O)SCc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6207 |
| logD: | 4.6116 |
| logSw: | -4.4642 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.331 |
| InChI Key: | PWBNNGUXMCZSCL-UHFFFAOYSA-N |