propan-2-yl 2-[(4-{[2-fluoro-N-(propan-2-yl)benzamido]methyl}phenoxy)sulfonyl]benzoate
Chemical Structure Depiction of
propan-2-yl 2-[(4-{[2-fluoro-N-(propan-2-yl)benzamido]methyl}phenoxy)sulfonyl]benzoate
propan-2-yl 2-[(4-{[2-fluoro-N-(propan-2-yl)benzamido]methyl}phenoxy)sulfonyl]benzoate
Compound characteristics
| Compound ID: | V031-2030 |
| Compound Name: | propan-2-yl 2-[(4-{[2-fluoro-N-(propan-2-yl)benzamido]methyl}phenoxy)sulfonyl]benzoate |
| Molecular Weight: | 513.58 |
| Molecular Formula: | C27 H28 F N O6 S |
| Smiles: | CC(C)N(Cc1ccc(cc1)OS(c1ccccc1C(=O)OC(C)C)(=O)=O)C(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9523 |
| logD: | 4.9523 |
| logSw: | -4.6389 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.387 |
| InChI Key: | KRNACEOJZBXCBF-UHFFFAOYSA-N |