4-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-9322 |
| Compound Name: | 4-{[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)Oc1ccc(CN(CC2CC2)C(c2ccccc2[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.942 |
| logD: | 4.942 |
| logSw: | -4.9172 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.006 |
| InChI Key: | CFCYBWSOHVNWPF-UHFFFAOYSA-N |