ABT-255

CAT: 0931-T29527-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T29527-02Size:50 mg

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

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CAS Number

186293-38-9

Target

Others, Antibacterial

Related Pathways

Microbiology/Virology, Others

Bioactivity

ABT-255 is a novel 2-pyridone antimicrobial agent for the treatment of tuberculosis. Both drug-sensitive and drug-resistant strains of Mycobacterium tuberculosis showed efficacy in vitro and in vivo.

Smiles

CC=1C2=C(C=C(C(O)=O)C(=O)N2C=C(F)C1N3C[C@]4([C@@](C3)(NCCC4)[H])[H])C5CC5

Molecular Formula

C21H24FN3O3

Molecular Weight

385.43

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

ABT-255 free base

CAS Number	186293-38-9
PubChem CID	463888
IUPAC Name	8-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid
Molecular Formula	C21H24FN3O3
Molecular Weight	385.4
XLogP	-0.5
Topological Polar Surface Area	72.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	28
Formal Charge	0
Complexity	897

SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C3CC3)F)N4C[C@@H]5CCCN[C@@H]5C4

InChI

InChI=1S/C21H24FN3O3/c1-11-18-14(12-4-5-12)7-15(21(27)28)20(26)25(18)9-16(22)19(11)24-8-13-3-2-6-23-17(13)10-24/h7,9,12-13,17,23H,2-6,8,10H2,1H3,(H,27,28)/t13-,17+/m0/s1

InChIKey

LPFFKRSIFTURFF-SUMWQHHRSA-N

Chemical Structure

2D Structure

CAS: 186293-38-9

CID: 463888

Formula: C21H24FN3O3

MW: 385.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	385.4
XLogP3	-0.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	385.18016980
Monoisotopic Mass	385.18016980
Topological Polar Surface Area	72.9 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	897
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T78202	IV-255
T79476-01	SCAL-255
T40951-01	ABT-107
T69503-01	ABT-518
T4668L-01	ABT-702
T29523-01	ABT 29666
T26524-01	ABT-080
T14085	ABT-046
T14088-01	ABT-670
T29525-01	ABT-116

Alternative Products

Catalog	Name
MBS5779161	ABT-255
HY-113619A	ABT-255 (hydrochloride)
HY-113619	ABT-255 (free base)
HY-155554-01	SCAL-255
GTR19219880	IV-255
B7737-50	ABT
MBS131424	ABT-639 (ABT639; ABT 639)
cyt-1174-01	CTGF (183-255)
HY-W953714	CRBN ligand-255
HY-168674	Antibacterial agent 255

ABT-255

Chemical Information

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