Products for Research Use Only
RegisterLogin

ROS kinases-IN-2

CAT: 0127-BUP12167-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BUP12167-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
687576-28-9
Purity
=98%
Smiles
O=C(NCCC1=CC=C(C=C1)S(=O)(=O)N)C=2C=C(N=C3C=CC=CC32)C=4SC=CC4

Chemical Information

ROS kinases-IN-2
CAS Number687576-28-9
PubChem CID1261733
IUPAC NameN-[2-(4-sulfamoylphenyl)ethyl]-2-thiophen-2-ylquinoline-4-carboxamide
Molecular FormulaC22H19N3O3S2
Molecular Weight437.5
XLogP3.4
Topological Polar Surface Area139
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity688
SMILES
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N
InChI
InChI=1S/C22H19N3O3S2/c23-30(27,28)16-9-7-15(8-10-16)11-12-24-22(26)18-14-20(21-6-3-13-29-21)25-19-5-2-1-4-17(18)19/h1-10,13-14H,11-12H2,(H,24,26)(H2,23,27,28)
InChIKey
QGHYISYCZNANMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of ROS kinases-IN-2
CAS: 687576-28-9
CID: 1261733
Formula: C22H19N3O3S2
MW: 437.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight437.5
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass437.08678382
Monoisotopic Mass437.08678382
Topological Polar Surface Area139 Ų
Heavy Atom Count30
Formal Charge0
Complexity688
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
BUP12704-01ROS kinases-IN-1
BUP13992-01ROS inducer 2
BUP05174-01ROS inducer 1
BUP13990-01ROS inducer 3
BUP05515-01ROS-generating agent 1
BUP01311-01TIE-2/VEGFR-2 kinase-IN-5
BUP07980-01MTOR kinase Inhibitor 2
BUP08242-01Aurora kinase inhibitor-2
BUP04960-01TAO Kinase inhibitor 2
PC1003049-012,2,2-Trifluoroethyl 2,2,2-trichloroacetate

Alternative Products

CatalogName
HY-148314-01ROS kinases-IN-2
MBS5805169Aurora Kinases-IN-2
MBS5802957ROS kinases-IN-1
MBS5820415Aurora Kinases-IN-4
GTR19212745-01Aurora Kinases-IN-3
GTR19195298-01BRD4-Kinases-IN-3
GTR10474939Chicken Protein Kinases G
GTR10473657Canine Protein Kinases G
GTR10462705Bovine Protein Kinases G
GTR10419609Rat Protein Kinases G

Popular Products