Skp2 Inhibitor C1

CAT: 0127-BUP09971-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP09971-01Size:5 mg

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CAS Number

432001-69-9

Synonyms

SKPin C1

Purity

=95%

Smiles

OC(=O)COc1ccc(Br)cc1\C=C1/SC(=S)N(Cc2cccnc2)C1=O

Chemical Information

Skp2 Inhibitor C1

CAS Number	432001-69-9
PubChem CID	5733396
IUPAC Name	2-[4-bromo-2-[(Z)-[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid
Molecular Formula	C18H13BrN2O4S2
Molecular Weight	465.3
XLogP	3.7
Topological Polar Surface Area	137
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	27
Formal Charge	0
Complexity	630

SMILES

C1=CC(=CN=C1)CN2C(=O)/C(=C/C3=C(C=CC(=C3)Br)OCC(=O)O)/SC2=S

InChI

InChI=1S/C18H13BrN2O4S2/c19-13-3-4-14(25-10-16(22)23)12(6-13)7-15-17(24)21(18(26)27-15)9-11-2-1-5-20-8-11/h1-8H,9-10H2,(H,22,23)/b15-7-

InChIKey

IYCJJVVXEHZJHE-CHHVJCJISA-N

Chemical Structure

2D Structure

CAS: 432001-69-9

CID: 5733396

Formula: C18H13BrN2O4S2

MW: 465.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	465.3
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	463.95001
Monoisotopic Mass	463.95001
Topological Polar Surface Area	137 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	630
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BUP00863-01	Skp2 inhibitor 1
BUP03079-01	PROCYANIDIN C1
BUP02891-01	Quin C1
BUP05590-01	Sinocrassoside C1
OR1006844-01	(R) -C1-TunaPhos
OR1006174	Pomalidomide-C2-amido- (C1-O-C5-O-C1) 2-COOH
BUP11024-01	NH2-PEG6-C1-Boc
BUP10182-01	Propargyl-C1-NHS ester
BUP05690-01	Acid-C1-PEG5-Boc
OR1025585-01	Aeide-C1-NHS Ester

Catalog	Name
bs-60136C-01	SKP2-C25 --- Skp2 Inhibitor
T78194-01	Skp2 inhibitor 2
MBS5750404	Skp2 Inhibitor C1
GTR19238568-01	Skp2 inhibitor 3
HY-149293	Skp2 inhibitor 1
bs-60137C-01	SKPin C1 --- Skp2 Inhibitor
C13564-01	Skp2 inhibitor C1 (SKPin C1)
MBS130266-01	Skp2-Inhibitor-C1. SKPin C1
217795	SKP2 E3 Ligase Inhibitor II, SMIP004 (CRL1SKP2 Inhibitor II, p21/Cip1/CKI/Waf1 Activator II, N- (4-Butyl-2-methylphenyl) acetamide, p27/Kip1 Activator II, S-phase Kinase-associated Protein 2 Inhibitor II, SCFSKP2 Inhibitor II, Small Molecule Inhibitor of p27 Depletion 004)
217794	SKP2 E3 Ligase Inhibitor I, C1 (p21/Cip1/Waf1 Activator I; p27/Kip1 Activator I, S-phase Kinase-associated Protein 2 Inhibitor I; SCFSKP2 Inhibitor I, CRL1SKP2 Inhibitor I, (Z) -2- (4-Bromo-2- ((4-oxo-3- (pyridin-3-ylmethyl) -2-thioxothiazolidin-5-ylidene) methyl) phenoxy) acetic Acid)