3-({4-[(4-ethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoic acid
Chemical Structure Depiction of
3-({4-[(4-ethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoic acid
3-({4-[(4-ethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoic acid
Compound characteristics
| Compound ID: | 5591-2667 |
| Compound Name: | 3-({4-[(4-ethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoic acid |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C25 H20 N2 O5 S |
| Smiles: | CCc1ccc(cc1)S(/N=C1/C=C(C(c2ccccc12)=O)Nc1cccc(c1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7426 |
| logD: | 2.8568 |
| logSw: | -5.2338 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.54 |
| InChI Key: | RYVRPCQNGCQISY-UHFFFAOYSA-N |