5-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-2028 |
| Compound Name: | 5-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 499.56 |
| Molecular Formula: | C26 H26 F N O6 S |
| Smiles: | COc1ccc(cc1)S(=O)(=O)Oc1cc(CN(CC2CC2)C(c2cccc(c2)F)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.3035 |
| logD: | 4.3035 |
| logSw: | -4.4806 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.723 |
| InChI Key: | LPCFGQITKUKWMF-UHFFFAOYSA-N |