Compound Summary
Ro 04-6790 dihydrochloride
Compound Information
Ro 04-6790 dihydrochloride
Compound Name: | Ro 04-6790 dihydrochloride |
Compound CID: | 11957681 |
Synonyms: | Ro 04-6790 dihydrochloride 1197333-95-1 RO 04-6790 hydrochloride 4-Amino-N-2,6-bis(methylamino)-4-pyrimidinylbenzenesulfonamide dihydrochloride EU-0101045 More... |
Iupac Name: | 4-amino-N-[2,6-bis(methylamino)pyrimidin-4-yl]benzenesulfonamide;dihydrochloride |
InChI: | InChI=1S/C12H16N6O2S.2ClH/c1-14-10-7-11(17-12(15-2)16-10)18-21(19,20)9-5-3-8(13)4-6-9;;/h3-7H,13H2,1-2H3,(H3,14,15,16,17,18);2*1H |
InChIKey: | QOAXXMSJHQHSFV-UHFFFAOYSA-N |
Canonical Smiles: | CNC1=CC(=NC(=N1)NC)NS(=O)(=O)C2=CC=C(C=C2)N.Cl.Cl |
Isomeric Smiles: | CNC1=CC(=NC(=N1)NC)NS(=O)(=O)C2=CC=C(C=C2)N.Cl.Cl |
Molecular Weight: | 381.3 |
Molecular Formula: | C12H18Cl2N6O2S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Ro 04-6790 dihydrochloride
Molecular Weight: | 381.3 |
Molecular Formula: | C12H18Cl2N6O2S |
Hydrogen Bond Donor Count: | 6 |
Hydrogen Bond Acceptor Count: | 8 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 23 |
Complexity: | 418 |
Synonyms
Ro 04-6790 dihydrochloride
| Ro 04-6790 dihydrochloride | Ro 04-6790 dihydrochloride |
|---|---|
Ro 04-6790 dihydrochloride |
1197333-95-1 |
RO 04-6790 hydrochloride |
4-Amino-N-2,6-bis(methylamino)-4-pyrimidinylbenzenesulfonamide dihydrochloride |
EU-0101045 |
CHEMBL1256675 |
DTXSID401017563 |
Tox21_501045 |
Ro 04-6790 dihydrochloride, solid |
CCG-222349 |
LP01045 |
4-amino-N-2,6-bis(methylamino)pyrimidin-4-ylbenzenesulfonamide;dihydrochloride |
NCGC00094330-01 |
NCGC00261730-01 |
R-140 |
SR-01000076009 |
J-013145 |
SR-01000076009-2 |
4-AMINO-N-(2,6-BIS-METHYLAMINO-PYRIMIDIN-4-YL)-BENZENESULFONAMIDE HYDROCHOLORIDE |
4-Amino-N-2,6-bis(methylamino)-4-pyrimidinyl-benzenesulfonamide dihydrochloride |
Experimental Data
Ro 04-6790 dihydrochloride
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | 1.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Ro 04-6790 dihydrochloride
Statistics Data
Ro 04-6790 dihydrochloride
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 1.000000000000000 | 1 | 1 |
Statistics Data Visualization
Ro 04-6790 dihydrochloride
