4-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-9382 |
| Compound Name: | 4-{[N-(cyclopropylmethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C24 H31 N O5 S |
| Smiles: | CC(C)(C)CC(N(CC1CC1)Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0361 |
| logD: | 5.0361 |
| logSw: | -4.7083 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.75 |
| InChI Key: | PZKWNJUGZQWJMD-UHFFFAOYSA-N |