2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7505 |
| Compound Name: | 2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 485.99 |
| Molecular Formula: | C25 H24 Cl N O5 S |
| Smiles: | COc1ccc(cc1)S(=O)(=O)Oc1ccccc1CN(CC1CC1)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1795 |
| logD: | 5.1795 |
| logSw: | -5.4162 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.093 |
| InChI Key: | WJSUMWXXAQVXIT-UHFFFAOYSA-N |