Products for Research Use Only
RegisterLogin

Ianthelliformisamine A TFA

CAT: 0931-T27569-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T27569-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1643593-28-5
Target
Others, Antibacterial
Related Pathways
Microbiology/Virology, Others
Bioactivity
Ianthelliformisamine A TFA, an antibiotic enhancer, is used to against resistant Gram-negative bacteria.
Smiles
OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COc1c(Br)cc(\C=C\C(=O)NCCCNCCCCNCCCN)cc1Br
Molecular Formula
C24H34Br2F6N4O6
Molecular Weight
748.356
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ianthelliformisamine A TFA
CAS Number1643593-28-5
PubChem CID168012538
IUPAC Name(E)-N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-(3,5-dibromo-4-methoxyphenyl)prop-2-enamide;bis(2,2,2-trifluoroacetic acid)
Molecular FormulaC24H34Br2F6N4O6
Molecular Weight748.3
Topological Polar Surface Area163
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count15
Rotatable Bond Count15
Heavy Atom Count42
Formal Charge0
Complexity512
SMILES
COC1=C(C=C(C=C1Br)/C=C/C(=O)NCCCNCCCCNCCCN)Br.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C20H32Br2N4O2.2C2HF3O2/c1-28-20-17(21)14-16(15-18(20)22)6-7-19(27)26-13-5-12-25-10-3-2-9-24-11-4-8-23;2*3-2(4,5)1(6)7/h6-7,14-15,24-25H,2-5,8-13,23H2,1H3,(H,26,27);2*(H,6,7)/b7-6+;;
InChIKey
DZMPXFAEQQJZAQ-KMXZHCNGSA-N
Chemical Structure
2D Structure
2D structure of Ianthelliformisamine A TFA
CAS: 1643593-28-5
CID: 168012538
Formula: C24H34Br2F6N4O6
MW: 748.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight748.3
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count15
Rotatable Bond Count15
Exact Mass748.07288
Monoisotopic Mass746.07493
Topological Polar Surface Area163 Ų
Heavy Atom Count42
Formal Charge0
Complexity512
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

Related Products

CatalogName
T83742-01SBP1 TFA
T83736-01RTDLDSLRTYTL TFA
T83714-01LAP TFA
T83707-01F9170 TFA
T83702-01E70K TFA
T75801-01TC14012 TFA
T33876L1-01Panomifene TFA
T68166L-01Traxanox TFA
T36201L-01AZD5582 TFA
T33836L-01Oxamisole TFA

Alternative Products

CatalogName
GTR19224365-01Ianthelliformisamine A TFA
HY-130280Ianthelliformisamine A (TFA)
HY-130282Ianthelliformisamine C (ditrifluoroacetate)
GTR19224364-01Ianthelliformisamine B TFA
MBS5777281Ianthelliformisamine C TFA
HY-130281Ianthelliformisamine B (diTFA)

Popular Products