methyl 2-({4-[(2,4-dimethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({4-[(2,4-dimethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoate
methyl 2-({4-[(2,4-dimethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoate
Compound characteristics
| Compound ID: | 5591-2380 |
| Compound Name: | methyl 2-({4-[(2,4-dimethylbenzene-1-sulfonyl)imino]-1-oxo-1,4-dihydronaphthalen-2-yl}amino)benzoate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C26 H22 N2 O5 S |
| Smiles: | Cc1ccc(c(C)c1)S(/N=C1/C=C(C(c2ccccc12)=O)Nc1ccccc1C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4064 |
| logD: | 5.3648 |
| logSw: | -5.3718 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.608 |
| InChI Key: | IRTXPKCYQRNATD-UHFFFAOYSA-N |