N'-(4-methylbenzene-1-sulfonyl)-N-(phenylcarbamothioyl)benzenecarboximidamide
Chemical Structure Depiction of
N'-(4-methylbenzene-1-sulfonyl)-N-(phenylcarbamothioyl)benzenecarboximidamide
N'-(4-methylbenzene-1-sulfonyl)-N-(phenylcarbamothioyl)benzenecarboximidamide
Compound characteristics
| Compound ID: | 2018-0182 |
| Compound Name: | N'-(4-methylbenzene-1-sulfonyl)-N-(phenylcarbamothioyl)benzenecarboximidamide |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C21 H19 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(/N=C(\c1ccccc1)NC(Nc1ccccc1)=S)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7056 |
| logD: | 4.7042 |
| logSw: | -4.4008 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.599 |
| InChI Key: | KGQQJVZZQBFORJ-UHFFFAOYSA-N |