5-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
5-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-3690 |
| Compound Name: | 5-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 529.59 |
| Molecular Formula: | C26 H28 F N3 O6 S |
| Smiles: | CCNC(N(Cc1ccc(cc1)F)Cc1ccc(c(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9906 |
| logD: | 2.9905 |
| logSw: | -3.5191 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.959 |
| InChI Key: | QNLKVAPYBDNDRZ-UHFFFAOYSA-N |