5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate
Chemical Structure Depiction of
5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate
5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-4608 |
| Compound Name: | 5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C18 H30 N2 O6 S |
| Smiles: | CCS(=O)(=O)Oc1cc(CN(CCOC)C(NC(C)(C)C)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.0681 |
| logD: | 2.068 |
| logSw: | -2.9777 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.834 |
| InChI Key: | MUWXPNIECSVWTQ-UHFFFAOYSA-N |