2-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
2-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl methanesulfonate
2-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-3110 |
| Compound Name: | 2-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 353.48 |
| Molecular Formula: | C18 H27 N O4 S |
| Smiles: | CC(C)(C)CC(N(CC1CC1)Cc1ccccc1OS(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6704 |
| logD: | 3.6704 |
| logSw: | -3.7862 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.681 |
| InChI Key: | KMWNABLFZDZRLY-UHFFFAOYSA-N |