AL082D06

CAT: 1410-M13775-06Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1410-M13775-06Size:100 mg

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

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Description

AL 082D06 (D-06) is the first selective, nonsteroidal glucocorticoid receptor (GR) antagonist with Ki of 210 nM.

CAS Number

256925-03-8

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

409.91

Molecular Formula

C23H24ClN3O2

Notes

Research use only, not for human use.

Receptor

Glucocorticoid Receptor

Chemical Information

4,4'-((2-chloro-5-nitrophenyl)methylene)bis(N,N-dimethylaniline)

CAS Number	256925-03-8
PubChem CID	9822799
IUPAC Name	4-[(2-chloro-5-nitrophenyl)-[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline
Molecular Formula	C23H24ClN3O2
Molecular Weight	409.9
XLogP	6
Topological Polar Surface Area	52.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	29
Formal Charge	0
Complexity	495

SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H24ClN3O2/c1-25(2)18-9-5-16(6-10-18)23(17-7-11-19(12-8-17)26(3)4)21-15-20(27(28)29)13-14-22(21)24/h5-15,23H,1-4H3

InChIKey

IPICUXHYPAMJNC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 256925-03-8

CID: 9822799

Formula: C23H24ClN3O2

MW: 409.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	409.9
XLogP3	6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	409.1557047
Monoisotopic Mass	409.1557047
Topological Polar Surface Area	52.3 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	495
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