General Information of the Compound
Compound ID
CP0315551
Compound Name
2,4-dichloro-N-propan-2-yl-N-[2-(propan-2-ylamino)ethyl]benzenesulfonamide
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Synonyms
RN 1734
RN-1734
RN1734
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Structure
Formula
C14H22Cl2N2O2S
Molecular Weight
353.315
Canonical SMILES
CC(C)NCCN(C(C)C)S(=O)(=O)c1ccc(Cl)cc1Cl
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InChI
InChI=1S/C14H22Cl2N2O2S/c1-10(2)17-7-8-18(11(3)4)21(19,20)14-6-5-12(15)9-13(14)16/h5-6,9-11,17H,7-8H2,1-4H3
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InChIKey
IHYZMEAZAIFMTN-UHFFFAOYSA-N
Physicochemical Property
logP
3.3905
Rotatable Bonds
7
Heavy Atom Count
21
Polar Areas
49.41
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
21

"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).

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PubChem ID
CID: 3601086
SID: 129983755
ChEMBL ID
CHEMBL2324347
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
Protein ID: PT03081, Transient receptor potential cation channel subfamily V member 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 2300 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 2300 nM
Protein ID: PT04567, Transient receptor potential cation channel subfamily V member 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 3200 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 3200 nM
Protein ID: PT05418, Transient receptor potential cation channel subfamily V member 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 5900 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 5900 nM
Clinical Information about the Compound
Drug 1 ( RN1734 )
Drug Name RN1734
Target(s)
Transient receptor potential cation channel V4 (TRPV4)
Blocker (channel blocker)