5-[(N-cyclopropyl-3,3-dimethylbutanamido)methyl]-2-methoxyphenyl propane-2-sulfonate
Chemical Structure Depiction of
5-[(N-cyclopropyl-3,3-dimethylbutanamido)methyl]-2-methoxyphenyl propane-2-sulfonate
5-[(N-cyclopropyl-3,3-dimethylbutanamido)methyl]-2-methoxyphenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V008-2122 |
| Compound Name: | 5-[(N-cyclopropyl-3,3-dimethylbutanamido)methyl]-2-methoxyphenyl propane-2-sulfonate |
| Molecular Weight: | 397.53 |
| Molecular Formula: | C20 H31 N O5 S |
| Smiles: | CC(C)S(=O)(=O)Oc1cc(CN(C2CC2)C(CC(C)(C)C)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6984 |
| logD: | 3.6984 |
| logSw: | -4.018 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.248 |
| InChI Key: | XSFZKIWPNIUWOS-UHFFFAOYSA-N |