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CAY10594

CAT: 0926-FVB06734-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-FVB06734-01Size:25 mg
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CAS Number
1130067-34-3
MDL Number
MFCD18382100
Smiles
C1CN (CCC12C (=O) NCN2C3=CC=CC=C3) CCNC (=O) C4=CC5=CC=CC=C5C=C4
Molecular Formula
C26H28N4O2
Molecular Weight
428.53 g/mol
Controlled
No

Chemical Information

N-(2-(4-Oxo-1-phenyl-1,3,8-triazaspiro(4.5)decan-8-yl)ethyl)naphthalene-2-carboxamide

N-[2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)ethyl]-2-naphthalenecarboxamide is a naphthalenecarboxamide.

CAS Number1130067-34-3
PubChem CID25105715
IUPAC NameN-[2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)ethyl]naphthalene-2-carboxamide
Molecular FormulaC26H28N4O2
Molecular Weight428.5
XLogP3.9
Topological Polar Surface Area64.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity669
SMILES
C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CCNC(=O)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C26H28N4O2/c31-24(22-11-10-20-6-4-5-7-21(20)18-22)27-14-17-29-15-12-26(13-16-29)25(32)28-19-30(26)23-8-2-1-3-9-23/h1-11,18H,12-17,19H2,(H,27,31)(H,28,32)
InChIKey
FAIFAFUXFFWVNQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-(4-Oxo-1-phenyl-1,3,8-triazaspiro(4.5)decan-8-yl)ethyl)naphthalene-2-carboxamide
CAS: 1130067-34-3
CID: 25105715
Formula: C26H28N4O2
MW: 428.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight428.5
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass428.22122615
Monoisotopic Mass428.22122615
Topological Polar Surface Area64.7 Ų
Heavy Atom Count32
Formal Charge0
Complexity669
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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