5-(diethylamino)-2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
5-(diethylamino)-2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-1305 |
| Compound Name: | 5-(diethylamino)-2-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 543.66 |
| Molecular Formula: | C28 H34 F N3 O5 S |
| Salt: | not_available |
| Smiles: | CCNC(N(Cc1ccc(cc1)F)Cc1ccc(cc1OS(c1ccc(cc1)OC)(=O)=O)N(CC)CC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0654 |
| logD: | 5.0547 |
| logSw: | -4.8221 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.346 |
| InChI Key: | REVPQFATESGZCB-UHFFFAOYSA-N |