4-({(3-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({(3-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
4-({(3-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V014-1989 |
| Compound Name: | 4-({(3-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 434.51 |
| Molecular Formula: | C21 H26 N2 O6 S |
| Smiles: | COc1cccc(c1)NC(N(CC1CCCO1)Cc1ccc(cc1)OS(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5454 |
| logD: | 2.5454 |
| logSw: | -3.0327 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.346 |
| InChI Key: | BWLFAAHTMCXJHP-HXUWFJFHSA-N |