5-[(2-chloro-N-cyclopropylbenzamido)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-[(2-chloro-N-cyclopropylbenzamido)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
5-[(2-chloro-N-cyclopropylbenzamido)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-0436 |
| Compound Name: | 5-[(2-chloro-N-cyclopropylbenzamido)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 529.01 |
| Molecular Formula: | C26 H25 Cl N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1cc(CN(C2CC2)C(c2ccccc2[Cl])=O)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7374 |
| logD: | 3.7373 |
| logSw: | -4.1065 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.494 |
| InChI Key: | BZGKXBCSQAMHMC-UHFFFAOYSA-N |