Zaldaride (free base)

CAT: 0931-T71451-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T71451-01Size:25 mg

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

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CAS Number

109826-26-8

Target

CaMK, Others

Related Pathways

Neuroscience, Others

Bioactivity

Zaldaride (free base) is a calmodulin antagonist.

Smiles

C(C1(C)C=2N(C=3C(CO1)=CC=CC3)C=CC2)N4CCC(CC4)N5C=6C(NC5=O)=CC=CC6

Molecular Formula

C26H28N4O2

Molecular Weight

428.53

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Zaldaride

3-[1-[(4-methyl-6H-pyrrolo[1,2-a][4,1]benzoxazepin-4-yl)methyl]-4-piperidinyl]-1H-benzimidazol-2-one is a member of benzimidazoles.

CAS Number	109826-26-8
PubChem CID	65909
IUPAC Name	3-[1-[(4-methyl-6H-pyrrolo[1,2-a][4,1]benzoxazepin-4-yl)methyl]piperidin-4-yl]-1H-benzimidazol-2-one
Molecular Formula	C26H28N4O2
Molecular Weight	428.5
XLogP	2.9
Topological Polar Surface Area	49.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	32
Formal Charge	0
Complexity	695

SMILES

CC1(C2=CC=CN2C3=CC=CC=C3CO1)CN4CCC(CC4)N5C6=CC=CC=C6NC5=O

InChI

InChI=1S/C26H28N4O2/c1-26(24-11-6-14-29(24)22-9-4-2-7-19(22)17-32-26)18-28-15-12-20(13-16-28)30-23-10-5-3-8-21(23)27-25(30)31/h2-11,14,20H,12-13,15-18H2,1H3,(H,27,31)

InChIKey

HTGCJAAPDHZCHL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109826-26-8

CID: 65909

Formula: C26H28N4O2

MW: 428.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	428.5
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	428.22122615
Monoisotopic Mass	428.22122615
Topological Polar Surface Area	49.7 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	695
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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Zaldaride (free base)

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