3,3'-[methylenebis(4,1-phenylenesulfonyl)]dipropanenitrile
Chemical Structure Depiction of
3,3'-[methylenebis(4,1-phenylenesulfonyl)]dipropanenitrile
3,3'-[methylenebis(4,1-phenylenesulfonyl)]dipropanenitrile
Compound characteristics
Compound ID: | 0091-0110 |
Compound Name: | 3,3'-[methylenebis(4,1-phenylenesulfonyl)]dipropanenitrile |
Molecular Weight: | 402.49 |
Molecular Formula: | C19 H18 N2 O4 S2 |
Smiles: | C(CS(c1ccc(Cc2ccc(cc2)S(CCC#N)(=O)=O)cc1)(=O)=O)C#N |
Stereo: | ACHIRAL |
logP: | 0.8834 |
logD: | 0.8834 |
logSw: | -2.1673 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 93.023 |
InChI Key: | KYPXPYHKVJHBQN-UHFFFAOYSA-N |