RIPGBM

CAT: 0127-BUP09887-05Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP09887-05Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

355406-76-7

Purity

=98%

Smiles

CC(=O)N(CC1=CC=C(F)C=C1)C1=C(NCC2=CC=CC=C2)C(=O)C2=C(C=CC=C2)C1=O

Chemical Information

Ripgbm

CAS Number	355406-76-7
PubChem CID	3793001
IUPAC Name	N-[3-(benzylamino)-1,4-dioxonaphthalen-2-yl]-N-[(4-fluorophenyl)methyl]acetamide
Molecular Formula	C26H21FN2O3
Molecular Weight	428.5
XLogP	4.3
Topological Polar Surface Area	66.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	32
Formal Charge	0
Complexity	750

SMILES

CC(=O)N(CC1=CC=C(C=C1)F)C2=C(C(=O)C3=CC=CC=C3C2=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H21FN2O3/c1-17(30)29(16-19-11-13-20(27)14-12-19)24-23(28-15-18-7-3-2-4-8-18)25(31)21-9-5-6-10-22(21)26(24)32/h2-14,28H,15-16H2,1H3

InChIKey

COATXBHZYVUJQP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 355406-76-7

CID: 3793001

Formula: C26H21FN2O3

MW: 428.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	428.5
XLogP3	4.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	428.15362070
Monoisotopic Mass	428.15362070
Topological Polar Surface Area	66.5 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	750
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes