4-[(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
Chemical Structure Depiction of
4-[(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
4-[(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
Compound characteristics
| Compound ID: | 8007-4603 |
| Compound Name: | 4-[(2-carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate |
| Molecular Weight: | 399.8 |
| Molecular Formula: | C16 H12 Cl F2 N3 O3 S |
| Smiles: | COc1cc(\C=N/NC(N)=S)ccc1OC(c1cc(c(cc1[Cl])F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1662 |
| logD: | 4.1662 |
| logSw: | -4.7464 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.142 |
| InChI Key: | GBBFUIARSXOBGN-UHFFFAOYSA-N |