N,N-bis(cyanomethyl)-2-[(propan-2-yl)sulfanyl]benzamide
Chemical Structure Depiction of
N,N-bis(cyanomethyl)-2-[(propan-2-yl)sulfanyl]benzamide
N,N-bis(cyanomethyl)-2-[(propan-2-yl)sulfanyl]benzamide
Compound characteristics
| Compound ID: | Y031-6041 |
| Compound Name: | N,N-bis(cyanomethyl)-2-[(propan-2-yl)sulfanyl]benzamide |
| Molecular Weight: | 273.35 |
| Molecular Formula: | C14 H15 N3 O S |
| Smiles: | CC(C)Sc1ccccc1C(N(CC#N)CC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7041 |
| logD: | 1.7041 |
| logSw: | -2.6177 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.661 |
| InChI Key: | MLAJEGXRCJSSQG-UHFFFAOYSA-N |