methyl 4-({1-oxo-4-[(thiophene-2-sulfonyl)imino]-1,4-dihydronaphthalen-2-yl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({1-oxo-4-[(thiophene-2-sulfonyl)imino]-1,4-dihydronaphthalen-2-yl}amino)benzoate
methyl 4-({1-oxo-4-[(thiophene-2-sulfonyl)imino]-1,4-dihydronaphthalen-2-yl}amino)benzoate
Compound characteristics
| Compound ID: | 5591-2536 |
| Compound Name: | methyl 4-({1-oxo-4-[(thiophene-2-sulfonyl)imino]-1,4-dihydronaphthalen-2-yl}amino)benzoate |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C22 H16 N2 O5 S2 |
| Smiles: | COC(c1ccc(cc1)NC1=C/C(c2ccccc2C1=O)=N/S(c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4158 |
| logD: | 4.4155 |
| logSw: | -4.5141 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.325 |
| InChI Key: | BWRDRJXLTAYQCR-UHFFFAOYSA-N |