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ORM-10962

CAT: 0607-BA6787-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA6787-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
763926-98-3
Form
A solid
Molecular Formula
C27H29N3O4
Molecular Weight
459.54
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Orm-10962

ORM-10962 is an organic molecular entity. It has a role as an ion transport inhibitor.

CAS Number763926-98-3
PubChem CID69016811
IUPAC Name2-(4-hydroxypiperidin-1-yl)-N-[6-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]-3-pyridinyl]acetamide
Molecular FormulaC27H29N3O4
Molecular Weight459.5
XLogP3.7
Topological Polar Surface Area83.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count34
Formal Charge0
Complexity650
SMILES
C1CC2=C(C=CC(=C2)OC3=NC=C(C=C3)NC(=O)CN4CCC(CC4)O)OC1C5=CC=CC=C5
InChI
InChI=1S/C27H29N3O4/c31-22-12-14-30(15-13-22)18-26(32)29-21-7-11-27(28-17-21)33-23-8-10-25-20(16-23)6-9-24(34-25)19-4-2-1-3-5-19/h1-5,7-8,10-11,16-17,22,24,31H,6,9,12-15,18H2,(H,29,32)
InChIKey
UPGUBLDTYLMRHO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Orm-10962
CAS: 763926-98-3
CID: 69016811
Formula: C27H29N3O4
MW: 459.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight459.5
XLogP33.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass459.21580641
Monoisotopic Mass459.21580641
Topological Polar Surface Area83.9 Ų
Heavy Atom Count34
Formal Charge0
Complexity650
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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