5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate
5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate
Compound characteristics
| Compound ID: | V026-2522 |
| Compound Name: | 5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C16 H26 N2 O5 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(C)(=O)=O)OC)C(NCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1132 |
| logD: | 2.1132 |
| logSw: | -2.9693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.684 |
| InChI Key: | QVUBQFOLBSQAAN-LBPRGKRZSA-N |