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5-Nitro BAPTA

CAT: 0931-T85492-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T85492-02Size:50 mg
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CAS Number
124251-83-8
Target
Others
Related Pathways
Others
Bioactivity
5-Nitro BAPTA, a calcium chelator, combined with 2-Me-substituted TM (as a fluorescent moiety), forms a red fluorescent probe (CaTM-2 AM) for imaging cytoplasmic Ca 2+ in cultured living cells. It serves as a building block for synthesizing Ca 2+ specific chelators, Ca 2+ buffers, and fluorescent Ca 2+ indicators [1] [2].
Smiles
O=C(O)CN(C=1C=CC=CC1OCCOC2=CC(=CC=C2N(CC(=O)O)CC(=O)O)N(=O)=O)CC(=O)O
Molecular Formula
C22H23N3O12
Molecular Weight
521.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-Nitro BAPTA
CAS Number124251-83-8
PubChem CID53971220
IUPAC Name2-[2-[2-[2-[bis(carboxymethyl)amino]phenoxy]ethoxy]-N-(carboxymethyl)-4-nitroanilino]acetic acid
Molecular FormulaC22H23N3O12
Molecular Weight521.4
XLogP2
Topological Polar Surface Area220
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count14
Rotatable Bond Count15
Heavy Atom Count37
Formal Charge0
Complexity787
SMILES
C1=CC=C(C(=C1)N(CC(=O)O)CC(=O)O)OCCOC2=C(C=CC(=C2)[N+](=O)[O-])N(CC(=O)O)CC(=O)O
InChI
InChI=1S/C22H23N3O12/c26-19(27)10-23(11-20(28)29)15-3-1-2-4-17(15)36-7-8-37-18-9-14(25(34)35)5-6-16(18)24(12-21(30)31)13-22(32)33/h1-6,9H,7-8,10-13H2,(H,26,27)(H,28,29)(H,30,31)(H,32,33)
InChIKey
JRTCJLPFWVGNQV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Nitro BAPTA
CAS: 124251-83-8
CID: 53971220
Formula: C22H23N3O12
MW: 521.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight521.4
XLogP32
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count14
Rotatable Bond Count15
Exact Mass521.12817318
Monoisotopic Mass521.12817318
Topological Polar Surface Area220 Ų
Heavy Atom Count37
Formal Charge0
Complexity787
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

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Alternative Products

CatalogName
HY-D16365-Nitro BAPTA
285407-015-Nitro BAPTA free acid
HY-D16375-Nitro BAPTA tetramethyl ester
sc-2735165,5'-Dibromo-BAPTA
HY-1471865,5'-Difluoro BAPTA
HY-D16415,5'-Dimethyl BAPTA (tetrapotassium)
GW0175-10mg5,5''-Difluoro BAPTA-AM
GTR19351139-015,5'-Dibromo BAPTA tetrapotassium
GTR19351138-015,5'-Dimethyl BAPTA tetrapotassium
HY-D16395,5'-Dibromo BAPTA (tetrapotassium)

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