N-[3-(3,4-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[3-(3,4-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide
N-[3-(3,4-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide
Compound characteristics
Compound ID: | 5591-2589 |
Compound Name: | N-[3-(3,4-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide |
Molecular Weight: | 422.52 |
Molecular Formula: | C22 H18 N2 O3 S2 |
Smiles: | Cc1ccc(cc1C)NC1=C/C(c2ccccc2C1=O)=N/S(c1cccs1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.3125 |
logD: | 5.2907 |
logSw: | -5.3673 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.151 |
InChI Key: | RCJXRPXEAUYXLA-UHFFFAOYSA-N |