2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-3990 |
| Compound Name: | 2-methoxy-5-({3-methyl-N-[(oxolan-2-yl)methyl]butanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 479.57 |
| Molecular Formula: | C24 H30 F N O6 S |
| Smiles: | CC(C)CC(N(CC1CCCO1)Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4771 |
| logD: | 3.4771 |
| logSw: | -3.8216 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.055 |
| InChI Key: | YKDUOSJYCRDSCZ-HXUWFJFHSA-N |