5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate
5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate
Compound characteristics
| Compound ID: | V027-5141 |
| Compound Name: | 5-{[N-(butan-2-yl)(ethyl)carbamamido]methyl}-2-methoxyphenyl ethanesulfonate |
| Molecular Weight: | 372.48 |
| Molecular Formula: | C17 H28 N2 O5 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(CC)(=O)=O)OC)C(NCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4769 |
| logD: | 2.4769 |
| logSw: | -2.9615 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.644 |
| InChI Key: | RTXTXAGGYCERRZ-ZDUSSCGKSA-N |