2-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
2-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-0248 |
| Compound Name: | 2-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 476.59 |
| Molecular Formula: | C24 H32 N2 O6 S |
| Smiles: | CC(C)(C)NC(N(CC1CCCO1)Cc1ccccc1OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0029 |
| logD: | 4.0028 |
| logSw: | -4.1475 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.463 |
| InChI Key: | NEYIPOSWHVUVIF-HXUWFJFHSA-N |