BB-78485

CAT: 0931-T26748-07Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0931-T26748-07Size:500 mg

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

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CAS Number

207732-11-4

Target

Others, Antibacterial

Related Pathways

Microbiology/Virology, Others

Purity

>99.99%

Bioactivity

BB-78485 is a potent small molecule inhibitor of LpxC metalloenzymes with antibacterial activity. The IC50 value of BB-78485 against LpxC is 160 nM. BB-78485 can be used for the study of Gram-negative bacterial infections.

Smiles

S(N[C@H](CC1=CC2=C(C=C1)C=CC=C2)C(NO)=O)(=O)(=O)C3=CC4=C(C=C3)C=CC=C4

Molecular Formula

C23H20N2O4S

Molecular Weight

420.48

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

BB-78485

structure in first source

CAS Number	207732-11-4
PubChem CID	9823454
IUPAC Name	(2R)-N-hydroxy-3-naphthalen-2-yl-2-(naphthalen-2-ylsulfonylamino)propanamide
Molecular Formula	C23H20N2O4S
Molecular Weight	420.5
XLogP	4.2
Topological Polar Surface Area	104
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	30
Formal Charge	0
Complexity	692

SMILES

C1=CC=C2C=C(C=CC2=C1)C[C@H](C(=O)NO)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H20N2O4S/c26-23(24-27)22(14-16-9-10-17-5-1-3-7-19(17)13-16)25-30(28,29)21-12-11-18-6-2-4-8-20(18)15-21/h1-13,15,22,25,27H,14H2,(H,24,26)/t22-/m1/s1

InChIKey

MMOUXLMPQFMDRD-JOCHJYFZSA-N

Chemical Structure

2D Structure

CAS: 207732-11-4

CID: 9823454

Formula: C23H20N2O4S

MW: 420.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	420.5
XLogP3	4.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	420.11437830
Monoisotopic Mass	420.11437830
Topological Polar Surface Area	104 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	692
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
BUP07809-01	BB-78485
442172-01	BB 78485
MBS4380803-01	Creatine Phosphokinase-BB (CK-BB)
QY-E05656	Human Bb COMPONENT FACTOR (BB)
MBS439874-01	Creatine Kinase-BB (CK-BB)
167941	PDGF-BB, Recombinant, Human, (Human PDGF-BB, h-PDGF-BB, PDGFBB, PDGF BB, PDGF-BB, rh-PDGF-BB, recombinant human PDGF-BB, recombinant PDGF-BB, PDGF) discontinued
167940-01	PDGF-BB, Active, Recombinant, Mouse (Murine PDGF-BB, m-PDGF-BB, PDGFBB, PDGF-BB, PDGF BB, rm-PDGF-BB, recombinant murine PDGF-BB, recombinant PDGF-BB, PDGF) discontinued
N2168-20	Soyasaponin BB
NGS-HCG-U31-005	BB-TIME
GWB-880D61	CK-BB

BB-78485

Chemical Information

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