Thalidomide-O-C4-NH2 hydrochloride

CAT: 0127-BUP11472-01Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-BUP11472-01Size:10 mg

Selected

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

Quick Request Actions

CAS Number

2376990-29-1

Purity

=98%

Smiles

O=C1N(C(CC2)C(NC2=O)=O)C(C3=C1C=CC=C3OCCCCN)=O.[H]Cl

Chemical Information

4-(4-Aminobutoxy)-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione hydrochloride

CAS Number	2376990-29-1
PubChem CID	145874881
IUPAC Name	4-(4-aminobutoxy)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione;hydrochloride
Molecular Formula	C17H20ClN3O5
Molecular Weight	381.8
Topological Polar Surface Area	119
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	26
Formal Charge	0
Complexity	579

SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCCCCN.Cl

InChI

InChI=1S/C17H19N3O5.ClH/c18-8-1-2-9-25-12-5-3-4-10-14(12)17(24)20(16(10)23)11-6-7-13(21)19-15(11)22;/h3-5,11H,1-2,6-9,18H2,(H,19,21,22);1H

InChIKey

VRXZGWPQXJYEPH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2376990-29-1

CID: 145874881

Formula: C17H20ClN3O5

MW: 381.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	381.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	381.1091484
Monoisotopic Mass	381.1091484
Topological Polar Surface Area	119 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	579
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	2
Compound Is Canonicalized	Yes

Catalog	Name
PC108516-01	Thalidomide-O-Amido-C4-NH2 (TFA)
BUP14248-01	Thalidomide-O-amido-C4-NH2 TFA
BUP10167	Thalidomide-O-C6-NH2 hydrochloride
OR1038497-01	Thalidomide-4-O-C5-NH2 (hydrochloride)
BUP02571-01	Thalidomide-O-amido-C6-NH2 hydrochloride
OR1076483	Thalidomide-O-amide-C5-NH2 (hydrochloride)
OR1006888-01	Thalidomide-O-amido-PEG3-C2-NH2 (hydrochloride)
OR1036381	Thalidomide-O-amido-PEG4-C2-NH2 (hydrochloride)
BUP00568-01	Thalidomide-O-amido-PEG2-C2-NH2 hydrochloride
BUP10689-01	Thalidomide-O-amido-PEG-C2-NH2 hydrochloride

Catalog	Name
MBS5786303	Thalidomide-O-C4-NH2 hydrochloride
T77951-01	Thalidomide-5-O-C4-NH2 hydrochloride
HY-130948B-01	Thalidomide-4-O-C4-NH2 (hydrochloride)
HY-107438A-01	Thalidomide-O-amido-C4-NH2 (hydrochloride)
HY-149561-01	Thalidomide-5-O-C4-NH2 (hydrochloride)
T18815-01	Thalidomide-O-amido-C4-NH2 hydrochloride
HY-134984A	Thalidomide-NH-amido-C4-NH2 (hydrochloride)
GTR19261001-01	Thalidomide-NH-amido-C4-NH2 hydrochloride
MBS5800533	Thalidomide-O-C8-NH2 hydrochloride
MBS5800391	Thalidomide-O-C5-NH2 hydrochloride