BDM31827

CAT: 0931-T23779-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T23779-02Size:50 mg

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

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CAS Number

1388658-04-5

Target

Others, Antibacterial

Related Pathways

Others, Microbiology/Virology

Bioactivity

BDM31827 is an EthR inhibitor.

Smiles

N(C(COC1=CC(OC)=CC=C1)=O)C2=CC=C(C3=NC=4C(S3)=CC=CC4)C=C2

Molecular Formula

C22H18N2O3S

Molecular Weight

390.45

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(3-methoxyphenoxy)acetamide

CAS Number	1388658-04-5
PubChem CID	45103532
IUPAC Name	N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(3-methoxyphenoxy)acetamide
Molecular Formula	C22H18N2O3S
Molecular Weight	390.5
XLogP	5.1
Topological Polar Surface Area	88.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	28
Formal Charge	0
Complexity	512

SMILES

COC1=CC(=CC=C1)OCC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H18N2O3S/c1-26-17-5-4-6-18(13-17)27-14-21(25)23-16-11-9-15(10-12-16)22-24-19-7-2-3-8-20(19)28-22/h2-13H,14H2,1H3,(H,23,25)

InChIKey

FYJKPCFYYJGKDO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1388658-04-5

CID: 45103532

Formula: C22H18N2O3S

MW: 390.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	390.5
XLogP3	5.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	390.10381361
Monoisotopic Mass	390.10381361
Topological Polar Surface Area	88.7 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	512
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

Alternative Products

Catalog	Name
GTR19200613-01	BDM31827

BDM31827

Chemical Information

Alternative Products

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