N-[3-(4-butylanilino)-4-oxonaphthalen-1(4H)-ylidene]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-(4-butylanilino)-4-oxonaphthalen-1(4H)-ylidene]-4-methylbenzene-1-sulfonamide
N-[3-(4-butylanilino)-4-oxonaphthalen-1(4H)-ylidene]-4-methylbenzene-1-sulfonamide
Compound characteristics
Compound ID: | 5591-2731 |
Compound Name: | N-[3-(4-butylanilino)-4-oxonaphthalen-1(4H)-ylidene]-4-methylbenzene-1-sulfonamide |
Molecular Weight: | 458.58 |
Molecular Formula: | C27 H26 N2 O3 S |
Smiles: | CCCCc1ccc(cc1)NC1=C/C(c2ccccc2C1=O)=N/S(c1ccc(C)cc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 7.0806 |
logD: | 7.0758 |
logSw: | -5.7798 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.132 |
InChI Key: | NGTGSXOFKPDSIU-UHFFFAOYSA-N |