NB 598

CAT: 0957-S0338-01Size: 5 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0957-S0338-01Size:5 mg

Selected

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

Quick Request Actions

Description

NB-598 is a potent, competitive squalene epoxidase (SE) inhibitor. NB-598 suppresses cholesterol biosynthesis.

CAS Number

131060-14-5

Target

Others

Activity

Others

Molecular Formula

C27H31NOS2

Storage Conditions

3 years -20°C powder

Chemical Information

NB 598

decreases serum total & LDL-cholesterol levels; structure given in first source; inhibits squalene epoxidase

CAS Number	131060-14-5
PubChem CID	6443223
IUPAC Name	(E)-N-ethyl-6,6-dimethyl-N-[[3-[(4-thiophen-3-ylthiophen-2-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine
Molecular Formula	C27H31NOS2
Molecular Weight	449.7
XLogP	7.2
Topological Polar Surface Area	69
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	10
Heavy Atom Count	31
Formal Charge	0
Complexity	628

SMILES

CCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC(=CS2)C3=CSC=C3

InChI

InChI=1S/C27H31NOS2/c1-5-28(14-8-6-7-13-27(2,3)4)18-22-10-9-11-25(16-22)29-19-26-17-24(21-31-26)23-12-15-30-20-23/h6,8-12,15-17,20-21H,5,14,18-19H2,1-4H3/b8-6+

InChIKey

KIRGLCXNEVICOG-SOFGYWHQSA-N

Chemical Structure

2D Structure

CAS: 131060-14-5

CID: 6443223

Formula: C27H31NOS2

MW: 449.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	449.7
XLogP3	7.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	10
Exact Mass	449.18470696
Monoisotopic Mass	449.18470696
Topological Polar Surface Area	69 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	628
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

Related Products

Catalog	Name
E7480	BAY-598
E7480-5mg	BAY-598
S0627-100mg	PDEC-NB
S0627	PDEC-NB

Alternative Products

Catalog	Name
303-150	Riboclear (RNA Cleanup)
TBS10485-100	Tribio InVivoMAb Anti-Mouse TIGIT & PD-L1 Bispecific Antibody
TBS10191-1mg	Tetrahydrocannabinol (THC) Monoclonal Antibody
TBI3024-25MG	Ac-Leu-Leu-Nle-CHO (ALLN), Calpain inhibitor
122-101	ExgeneTM Forensic SV mini
TBS10483-100	Tribio InVivoMAb Anti-Mouse PD-L1 & CD28 Bispecific Antibody
TBS10183-1mg	Monoclonal Anti-Thyroid Stimulating Hormone (TSH) Antibody
TBS10340-0.5MG	InVivo Mouse IgG1 Isotype Control Antibody
121-220	Exfection Plasmid EF (Exdotoxin Free, Midi)
TBS10482-100	Tribio InVivoMAb Anti-Mouse PD-L1 & OX40 Bispecific Antibody

NB 598

Chemical Information

Related Products

Alternative Products

Popular Products