MID-1

CAT: 0607-BA8980-25Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0607-BA8980-25Size:25 mg

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

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CAS Number

312608-54-1

Form

A solid

Molecular Formula

C12H11N3O4S

Molecular Weight

293.30

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

4-Ethoxy-N-(5-nitrothiazol-2-yl)benzamide

CAS Number	312608-54-1
PubChem CID	2858708
IUPAC Name	4-ethoxy-N-(5-nitro-1,3-thiazol-2-yl)benzamide
Molecular Formula	C12H11N3O4S
Molecular Weight	293.30
XLogP	3.3
Topological Polar Surface Area	125
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	20
Formal Charge	0
Complexity	355

SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4S/c1-2-19-9-5-3-8(4-6-9)11(16)14-12-13-7-10(20-12)15(17)18/h3-7H,2H2,1H3,(H,13,14,16)

InChIKey

LMDLIMGAGZHZSR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 312608-54-1

CID: 2858708

Formula: C12H11N3O4S

MW: 293.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	293.30
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	293.04702701
Monoisotopic Mass	293.04702701
Topological Polar Surface Area	125 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	355
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

Catalog	Name
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T32673	Leucottetraoxy MID
PC35107	Mid-brain
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MBS620328-01	Endophilin 1, Mid, SH3 Domain
KT-101406	Dog N MID Osteocalcin (N-MID-OC) ELISA
MBS6473888-01	Endophilin 1, Mid, SH3 Domain (FITC)
CYC-1	1 well reservoir, 190ml; mid skirt
MBS6473895-01	Endophilin 1, Mid, SH3 Domain-PE
MBS6473889-01	Endophilin 1, Mid, SH3 Domain (HRP)