5-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)-2-methoxyphenyl ethanesulfonate
Chemical Structure Depiction of
5-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)-2-methoxyphenyl ethanesulfonate
5-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)-2-methoxyphenyl ethanesulfonate
Compound characteristics
| Compound ID: | V011-8301 |
| Compound Name: | 5-({(cyclobutanecarbonyl)[(4-fluorophenyl)methyl]amino}methyl)-2-methoxyphenyl ethanesulfonate |
| Molecular Weight: | 435.51 |
| Molecular Formula: | C22 H26 F N O5 S |
| Smiles: | CCS(=O)(=O)Oc1cc(CN(Cc2ccc(cc2)F)C(C2CCC2)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.8034 |
| logD: | 2.8034 |
| logSw: | -3.2147 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.527 |
| InChI Key: | JNAXWDHEHBBHLA-UHFFFAOYSA-N |