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YS-67

CAT: 0127-BUP08758-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP08758-05Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2761327-15-3
Purity
=98%
Smiles
N=1C=NC(=C2C=C(OCCCN3CCOCC3)C(OC)=CC12)C=4C=5C=CC=CC5N(C4C=6C=CC=CC6)CC

Chemical Information

4-[3-[4-(1-Ethyl-2-phenylindol-3-yl)-7-methoxyquinazolin-6-yl]oxypropyl]morpholine
CAS Number2761327-15-3
PubChem CID164628028
IUPAC Name4-[3-[4-(1-ethyl-2-phenylindol-3-yl)-7-methoxyquinazolin-6-yl]oxypropyl]morpholine
Molecular FormulaC32H34N4O3
Molecular Weight522.6
XLogP5.2
Topological Polar Surface Area61.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count39
Formal Charge0
Complexity745
SMILES
CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C4=NC=NC5=CC(=C(C=C54)OCCCN6CCOCC6)OC
InChI
InChI=1S/C32H34N4O3/c1-3-36-27-13-8-7-12-24(27)30(32(36)23-10-5-4-6-11-23)31-25-20-29(28(37-2)21-26(25)33-22-34-31)39-17-9-14-35-15-18-38-19-16-35/h4-8,10-13,20-22H,3,9,14-19H2,1-2H3
InChIKey
LZGZDXBHZFWXID-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-[3-[4-(1-Ethyl-2-phenylindol-3-yl)-7-methoxyquinazolin-6-yl]oxypropyl]morpholine
CAS: 2761327-15-3
CID: 164628028
Formula: C32H34N4O3
MW: 522.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight522.6
XLogP35.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass522.26309096
Monoisotopic Mass522.26309096
Topological Polar Surface Area61.6 Ų
Heavy Atom Count39
Formal Charge0
Complexity745
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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