Pomalidomide (CC-4047) 100mg

CAT: 0628-A10743-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0628-A10743-100Size:100 mg

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CAS Number

19171-19-8

Chemical Information

Pomalidomide

Pomalidomide is an aromatic amine that is thalidomide substituted at position 4 on the isoindole ring system by an amino group. Used for the treatment of multiple myeloma in patients who failed to respond to previous therapies. It has a role as an antineoplastic agent, an angiogenesis inhibitor and an immunomodulator. It is a member of isoindoles, an aromatic amine, a dicarboximide and a member of piperidones. It is functionally related to a thalidomide.

CAS Number	19171-19-8
PubChem CID	134780
IUPAC Name	4-amino-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
Molecular Formula	C13H11N3O4
Molecular Weight	273.24
XLogP	0.2
Topological Polar Surface Area	110
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	20
Formal Charge	0
Complexity	504

SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)N

InChI

InChI=1S/C13H11N3O4/c14-7-3-1-2-6-10(7)13(20)16(12(6)19)8-4-5-9(17)15-11(8)18/h1-3,8H,4-5,14H2,(H,15,17,18)

InChIKey

UVSMNLNDYGZFPF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19171-19-8

CID: 134780

Formula: C13H11N3O4

MW: 273.24

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	273.24
XLogP3	0.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	273.07495584
Monoisotopic Mass	273.07495584
Topological Polar Surface Area	110 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	504
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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A4212-5	Pomalidomide (CC-4047)
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Pomalidomide (CC-4047) 100mg

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