3-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
3-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl ethanesulfonate
3-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-5370 |
| Compound Name: | 3-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 340.44 |
| Molecular Formula: | C16 H24 N2 O4 S |
| Smiles: | CCNC(N(CC1CC1)Cc1cccc(c1)OS(CC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2705 |
| logD: | 2.2705 |
| logSw: | -2.8485 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.85 |
| InChI Key: | HHBKAUNZXQJXFS-UHFFFAOYSA-N |