General Information of the Compound
| Compound ID |
CP0401252
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[1-(4-chlorophenyl)-3-(dimethylamino)propyl] N-(4-tert-butylphenyl)carbamate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H29ClN2O2
|
||||||||||||||||||
| Molecular Weight |
388.939
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CCC(OC(=O)Nc1ccc(cc1)C(C)(C)C)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H29ClN2O2/c1-22(2,3)17-8-12-19(13-9-17)24-21(26)27-20(14-15-25(4)5)16-6-10-18(23)11-7-16/h6-13,20H,14-15H2,1-5H3,(H,24,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BYXDKMUOJWVBEJ-UHFFFAOYSA-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