General Information of the Compound
| Compound ID |
CP0473369
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S)-3-(4-chlorophenyl)-2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-N-(1-methylpiperidin-4-yl)propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H34ClN3O4S
|
||||||||||||||||||
| Molecular Weight |
508.084
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(C)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H34ClN3O4S/c1-16-14-23(33-5)17(2)18(3)24(16)34(31,32)28-22(15-19-6-8-20(26)9-7-19)25(30)27-21-10-12-29(4)13-11-21/h6-9,14,21-22,28H,10-13,15H2,1-5H3,(H,27,30)/t22-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
BHFAKTJSTIEQNS-QFIPXVFZSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound