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CBP/p300-IN-15

CAT: 0013-GTR19185547-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19185547-01Size:25 mg
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Description
CBP/p300-IN-15
CAS Number
2379409-91-1
Field of Research
Epigenetics & Chromatin, Signal Transduction
Smiles
O=C1[C@@]2 (C=3C (CC2) =CC (NC (NC) =O) =CC3) OC (=O) N1CC (=O) N4CC=5C (CC[C@H]4C) =CC=CC5
Molecular Formula
C26H28N4O5
Molecular Weight
476.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CBP/p300-IN-15
CAS Number2379409-91-1
PubChem CID146204995
IUPAC Name1-methyl-3-[(5R)-3-[2-[(3R)-3-methyl-1,3,4,5-tetrahydro-2-benzazepin-2-yl]-2-oxoethyl]-2,4-dioxospiro[1,3-oxazolidine-5,1'-2,3-dihydroindene]-5'-yl]urea
Molecular FormulaC26H28N4O5
Molecular Weight476.5
XLogP2.5
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count35
Formal Charge0
Complexity880
SMILES
C[C@@H]1CCC2=CC=CC=C2CN1C(=O)CN3C(=O)[C@]4(CCC5=C4C=CC(=C5)NC(=O)NC)OC3=O
InChI
InChI=1S/C26H28N4O5/c1-16-7-8-17-5-3-4-6-19(17)14-29(16)22(31)15-30-23(32)26(35-25(30)34)12-11-18-13-20(9-10-21(18)26)28-24(33)27-2/h3-6,9-10,13,16H,7-8,11-12,14-15H2,1-2H3,(H2,27,28,33)/t16-,26-/m1/s1
InChIKey
VDINOEOOUILKFN-AKJBCIBTSA-N
Chemical Structure
2D Structure
2D structure of CBP/p300-IN-15
CAS: 2379409-91-1
CID: 146204995
Formula: C26H28N4O5
MW: 476.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight476.5
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass476.20597001
Monoisotopic Mass476.20597001
Topological Polar Surface Area108 Ų
Heavy Atom Count35
Formal Charge0
Complexity880
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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