Products for Research Use Only

BB-78485

CAT: 0013-GTR19198141-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198141-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BB-78485 is a potent LpxC inhibitor with an IC50 of 160 nM, exhibiting antibacterial activity against Gram-negative bacteria. It serves as a valuable research tool for studying bacterial lipid A biosynthesis in both in vitro enzymatic assays and in vivo infection models.
CAS Number
207732-11-4
Product Name Alternative
BB 78485, BB78485, BB-78485, LpxC
Field of Research
Infectious Disease & Virology
Purity
97.90% (May vary between batches)
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
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

BB-78485

structure in first source

CAS Number207732-11-4
PubChem CID9823454
IUPAC Name(2R)-N-hydroxy-3-naphthalen-2-yl-2-(naphthalen-2-ylsulfonylamino)propanamide
Molecular FormulaC23H20N2O4S
Molecular Weight420.5
XLogP4.2
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity692
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
2D structure of BB-78485
CAS: 207732-11-4
CID: 9823454
Formula: C23H20N2O4S
MW: 420.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight420.5
XLogP34.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass420.11437830
Monoisotopic Mass420.11437830
Topological Polar Surface Area104 Ų
Heavy Atom Count30
Formal Charge0
Complexity692
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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