N-[3-(2,5-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[3-(2,5-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide
N-[3-(2,5-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | 5591-2553 |
| Compound Name: | N-[3-(2,5-dimethylanilino)-4-oxonaphthalen-1(4H)-ylidene]thiophene-2-sulfonamide |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C22 H18 N2 O3 S2 |
| Smiles: | Cc1ccc(C)c(c1)NC1=C/C(c2ccccc2C1=O)=N/S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6606 |
| logD: | 4.657 |
| logSw: | -4.527 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.453 |
| InChI Key: | OWBICSMKLQSPCR-UHFFFAOYSA-N |