5-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4583 |
| Compound Name: | 5-{[N-(cyclopropylmethyl)-2-methylpropanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C23 H29 N O6 S |
| Smiles: | CC(C)C(N(CC1CC1)Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.897 |
| logD: | 3.897 |
| logSw: | -4.1044 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.995 |
| InChI Key: | JPQFWBRPJJTYPX-UHFFFAOYSA-N |