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Desmethyl Narazaciclib

CAT: 1596-AR-N08361-04Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-N08361-04Size:100 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2419274-38-5
Molecular Formula
C11H8O2
Molecular Weight
415.50
API Name
Narazaciclib

Chemical Information

Desmethyl Narazaciclib
CAS Number2419274-38-5
PubChem CID146613984
IUPAC Name8-cyclopentyl-7-oxo-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidine-6-carbonitrile
Molecular FormulaC23H25N7O
Molecular Weight415.5
XLogP2.7
Topological Polar Surface Area97.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count31
Formal Charge0
Complexity725
SMILES
C1CCC(C1)N2C3=NC(=NC=C3C=C(C2=O)C#N)NC4=CC=C(C=C4)N5CCNCC5
InChI
InChI=1S/C23H25N7O/c24-14-16-13-17-15-26-23(28-21(17)30(22(16)31)20-3-1-2-4-20)27-18-5-7-19(8-6-18)29-11-9-25-10-12-29/h5-8,13,15,20,25H,1-4,9-12H2,(H,26,27,28)
InChIKey
KBPPTUDYXRJMOR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Desmethyl Narazaciclib
CAS: 2419274-38-5
CID: 146613984
Formula: C23H25N7O
MW: 415.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight415.5
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass415.21205845
Monoisotopic Mass415.21205845
Topological Polar Surface Area97.2 Ų
Heavy Atom Count31
Formal Charge0
Complexity725
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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Alternative Products

CatalogName
TRC-D658980-250MGDesmethyl Narazaciclib
TRC-D658981-25MGDesmethyl Narazaciclib-d8
HY-12624-01Narazaciclib
TRC-C445390-250MGNarazaciclib N-oxide
CS-T-103867Narazaciclib N-oxide-d3
TRC-C445391-100MGNarazaciclib N-oxide-d8
TRC-N577440-50MGN-Desmethyl N-Nitroso Desmethyl Doxylamine
MBS130369-01N-desmethyl MDV3100, N-desmethyl-Enzalutamide
HY-138101Desmethyl etoricoxib
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