5-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4525 |
| Compound Name: | 5-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 516.01 |
| Molecular Formula: | C26 H26 Cl N O6 S |
| Smiles: | COc1ccc(cc1)S(=O)(=O)Oc1cc(CN(CC2CC2)C(c2ccccc2[Cl])=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.6788 |
| logD: | 4.6788 |
| logSw: | -4.9002 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.723 |
| InChI Key: | BLDUVFPPWPKTKW-UHFFFAOYSA-N |