3-[(2-carbamothioylhydrazinylidene)methyl]phenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
3-[(2-carbamothioylhydrazinylidene)methyl]phenyl 3-chloro-1-benzothiophene-2-carboxylate
3-[(2-carbamothioylhydrazinylidene)methyl]phenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8009-5599 |
| Compound Name: | 3-[(2-carbamothioylhydrazinylidene)methyl]phenyl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C17 H12 Cl N3 O2 S2 |
| Smiles: | C(\c1cccc(c1)OC(c1c(c2ccccc2s1)[Cl])=O)=N/NC(N)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6958 |
| logD: | 4.6958 |
| logSw: | -5.037 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.171 |
| InChI Key: | XZTRXKVWUTXXLE-UHFFFAOYSA-N |