Products for Research Use Only
RegisterLogin

IMP-1700

CAT: 0931-T37729-02Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T37729-02Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1458674-25-3
Target
Others
Related Pathways
Others
Bioactivity
IMP-1700 is an inhibitor of bacterial DNA repair.1It potentiates the activity of the quinolone antibiotic ciprofloxacin against methicillin-resistantS. aureus (MRSA) with a combination index value of 0.7. IMP-1700 inhibits the ciprofloxacin-induced bacterial SOS response, a process that repairs DNA damage, in a reporter assay in a concentration-dependent manner. It is also active againstE. coli, as well as methicillin-resistant and -sensitive S. aureus, when used alone (EC50s = 0.5, 0.21, and 3.8 μM, respectively) .
Smiles
OC(=O)c1cn(C2CC2)c2cc(N3CCN(CC3)C(=S)Nc3ccc(cc3)C(F)(F)F)c(F)cc2c1=O
Molecular Formula
C25H22F4N4O3S
Molecular Weight
534.53
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Cyclopropyl-6-fluoro-4-oxo-7-[4-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperazin-1-yl]quinoline-3-carboxylic acid
CAS Number1458674-25-3
PubChem CID71747921
IUPAC Name1-cyclopropyl-6-fluoro-4-oxo-7-[4-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperazin-1-yl]quinoline-3-carboxylic acid
Molecular FormulaC25H22F4N4O3S
Molecular Weight534.5
XLogP4
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count37
Formal Charge0
Complexity943
SMILES
C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=S)NC5=CC=C(C=C5)C(F)(F)F)F)C(=O)O
InChI
InChI=1S/C25H22F4N4O3S/c26-19-11-17-20(33(16-5-6-16)13-18(22(17)34)23(35)36)12-21(19)31-7-9-32(10-8-31)24(37)30-15-3-1-14(2-4-15)25(27,28)29/h1-4,11-13,16H,5-10H2,(H,30,37)(H,35,36)
InChIKey
DMUZWIXJZNKJPP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Cyclopropyl-6-fluoro-4-oxo-7-[4-[[4-(trifluoromethyl)phenyl]carbamothioyl]piperazin-1-yl]quinoline-3-carboxylic acid
CAS: 1458674-25-3
CID: 71747921
Formula: C25H22F4N4O3S
MW: 534.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight534.5
XLogP34
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass534.13487440
Monoisotopic Mass534.13487440
Topological Polar Surface Area108 Ų
Heavy Atom Count37
Formal Charge0
Complexity943
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
T62869-01OM-1700
T9901A-1044-01IMP-761
T9350-01IMP-1088
T37591-01IMP-1710
T68322-01IMP-321
T209044-01IMP-1575
T208615-01IMP-2373
T73362-01C-di-IMP
T82760-01C-di-IMP disodium
T36984-01Cyclic di-IMP (sodium salt)

Alternative Products

CatalogName
533326IMP-1700
TBI3950-50MGIMP-1700, Bacterial DNA repair inhibitor
MBS5805547OM-1700
I8630-01IMP
193295-01Polyethylene for Synthesis MW-1700-4000
HY-155469IMP 241
HY-D2188-01IMP-2373
HY-155471IMP 245
HY-161175-01IMP-1575
MBS8534880-01IMP-3

Popular Products