2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V015-5057 |
| Compound Name: | 2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 486.56 |
| Molecular Formula: | C25 H27 F N2 O5 S |
| Smiles: | CCC(C)N(Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7001 |
| logD: | 5.7001 |
| logSw: | -5.4599 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.379 |
| InChI Key: | YUEKZIMAIZZKDF-SFHVURJKSA-N |