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ABT-472

CAT: 0013-GTR19198328-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198328-02Size:50 mg
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Description
ABT-472
CAS Number
943650-25-7
Field of Research
Epigenetics & Chromatin, Molecular Biology
Smiles
O=C (N) C1=CC=CC=2N=C (NC21) C3CCN (CCC) CC3.O=C (O) CCC (=O) O
Molecular Formula
C20H28N4O5
Molecular Weight
404.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(1-Propylpiperidin-4-yl)-1H-benzo[d]imidazole-7-carboxamide succinate
CAS Number943650-25-7
PubChem CID45480519
IUPAC Namebutanedioic acid;2-(1-propylpiperidin-4-yl)-1H-benzimidazole-4-carboxamide
Molecular FormulaC20H28N4O5
Molecular Weight404.5
Topological Polar Surface Area150
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity460
SMILES
CCCN1CCC(CC1)C2=NC3=C(C=CC=C3N2)C(=O)N.C(CC(=O)O)C(=O)O
InChI
InChI=1S/C16H22N4O.C4H6O4/c1-2-8-20-9-6-11(7-10-20)16-18-13-5-3-4-12(15(17)21)14(13)19-16;5-3(6)1-2-4(7)8/h3-5,11H,2,6-10H2,1H3,(H2,17,21)(H,18,19);1-2H2,(H,5,6)(H,7,8)
InChIKey
GWFBXGWIRCSOAO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(1-Propylpiperidin-4-yl)-1H-benzo[d]imidazole-7-carboxamide succinate
CAS: 943650-25-7
CID: 45480519
Formula: C20H28N4O5
MW: 404.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight404.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass404.20597001
Monoisotopic Mass404.20597001
Topological Polar Surface Area150 Ų
Heavy Atom Count29
Formal Charge0
Complexity460
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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