5-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-1624 |
| Compound Name: | 5-({N-[(furan-2-yl)methyl]-3-methylbutanamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 526.43 |
| Molecular Formula: | C24 H25 Cl2 N O6 S |
| Smiles: | CC(C)CC(N(Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3569 |
| logD: | 5.3569 |
| logSw: | -5.9362 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.149 |
| InChI Key: | COJRIOPTZMTEAY-UHFFFAOYSA-N |