(4-benzylpiperidin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone
Chemical Structure Depiction of
(4-benzylpiperidin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone
(4-benzylpiperidin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone
Compound characteristics
| Compound ID: | K781-2990 |
| Compound Name: | (4-benzylpiperidin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone |
| Molecular Weight: | 498.98 |
| Molecular Formula: | C25 H23 Cl N2 O5 S |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(c1ccc(c(c1)[N+]([O-])=O)S(c1cccc(c1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3222 |
| logD: | 5.3222 |
| logSw: | -5.9849 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.197 |
| InChI Key: | DVYRVXVRZBOVOK-UHFFFAOYSA-N |