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UNC0321 25mg

CAT: 0628-A13200-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0628-A13200-25Size:25 mg
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CAS Number
1238673-32-9

Chemical Information

Unc0321

7-[2-[2-(dimethylamino)ethoxy]ethoxy]-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methyl-4-piperidinyl)-4-quinazolinamine is a member of quinazolines.

CAS Number1238673-32-9
PubChem CID46901937
IUPAC Name7-[2-[2-(dimethylamino)ethoxy]ethoxy]-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine
Molecular FormulaC27H45N7O3
Molecular Weight515.7
XLogP2.9
Topological Polar Surface Area78.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Heavy Atom Count37
Formal Charge0
Complexity651
SMILES
CN1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)NC4CCN(CC4)C)OC)OCCOCCN(C)C
InChI
InChI=1S/C27H45N7O3/c1-31(2)15-16-36-17-18-37-25-20-23-22(19-24(25)35-5)26(28-21-7-11-33(4)12-8-21)30-27(29-23)34-10-6-9-32(3)13-14-34/h19-21H,6-18H2,1-5H3,(H,28,29,30)
InChIKey
AULLUGALUBVBDD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Unc0321
CAS: 1238673-32-9
CID: 46901937
Formula: C27H45N7O3
MW: 515.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight515.7
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Exact Mass515.35838832
Monoisotopic Mass515.35838832
Topological Polar Surface Area78.5 Ų
Heavy Atom Count37
Formal Charge0
Complexity651
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