XL388-C2-NH2

CAT: 0931-T39777Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T39777Size:25 mg

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

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CAS Number

2250061-94-8

Target

Others

Related Pathways

Others

Bioactivity

XL388-C2-NH2 is a monomeric compound with [M+] 495.12 [ (calcd), 495.32 (found) ] in HPLC/MS (ESI) and tR = 3.23 min (method A) .

Smiles

Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(=O)(=O)CCN

Molecular Formula

C24H25FN4O4S

Molecular Weight

484.54

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

XL388-C2-NH2

CAS Number	2250061-94-8
PubChem CID	135372833
IUPAC Name	[4-(2-aminoethylsulfonyl)-3-fluoro-2-methylphenyl]-[7-(6-amino-3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone
Molecular Formula	C24H25FN4O4S
Molecular Weight	484.5
XLogP	1.6
Topological Polar Surface Area	137
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Heavy Atom Count	34
Formal Charge	0
Complexity	809

SMILES

CC1=C(C=CC(=C1F)S(=O)(=O)CCN)C(=O)N2CCOC3=C(C2)C=C(C=C3)C4=CN=C(C=C4)N

InChI

InChI=1S/C24H25FN4O4S/c1-15-19(4-6-21(23(15)25)34(31,32)11-8-26)24(30)29-9-10-33-20-5-2-16(12-18(20)14-29)17-3-7-22(27)28-13-17/h2-7,12-13H,8-11,14,26H2,1H3,(H2,27,28)

InChIKey

QIXGYIWSGSFKFA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2250061-94-8

CID: 135372833

Formula: C24H25FN4O4S

MW: 484.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	484.5
XLogP3	1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	484.15805463
Monoisotopic Mass	484.15805463
Topological Polar Surface Area	137 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	809
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

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T17875-01	Pomalidomide-C2-NH2
T6030-01	XL388
T18813-01	Thalidomide-PEG2-C2-NH2
T16664-01	N3-PEG4-C2-NH2
T17916-01	Pomalidomide-PEG4-C2-NH2
T16311-01	NH2-PEG2-C2-Boc
T7761	Pomalidomide-C2-NH2 hydrochloride

Alternative Products

Catalog	Name
MBS5800187	XL388-C2-NH2
HY-139085A-01	XL388-C2-amide-PEG9-NH2 (hydrochloride)
HY-139085B-01	XL388-C2-amide-PEG9-NH2 (TFA)
A3940-5.1	XL388
BA2523-5.1	Indole-C2-amide-C2-NH2
GTR19225149-01	NH2-C2-amido-C2-Boc
BA6267-1	diABZI-C2-NH2
HY-128846-01	Pomalidomide-C2-NH2
HY-W017970-01	Boc-C2-NH2

XL388-C2-NH2

Chemical Information

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