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Unc0321 trifluoroacetate

CAT: 0926-JCD30225-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-JCD30225-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1934302-25-6
Smiles
CN1CCCN (CC1) C2=NC3=CC (=C (C=C3C (=N2) NC4CCN (CC4) C) OC) OCCOCCN (C) C.C (=O) (C (F) (F) F) O.C (=O) (C (F) (F) F) O.C (=O) (C (F) (F) F) O
Molecular Formula
C33H48F9N7O9
Molecular Weight
857.8 g/mol
Controlled
No

Chemical Information

7-(2-(2-(dimethylamino)ethoxy)ethoxy)-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine,tri(trifluoroacetate)salt
CAS Number1934302-25-6
PubChem CID132285113
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;tris(2,2,2-trifluoroacetic acid)
Molecular FormulaC33H48F9N7O9
Molecular Weight857.8
Topological Polar Surface Area190
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count25
Rotatable Bond Count11
Heavy Atom Count58
Formal Charge0
Complexity735
SMILES
CN1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)NC4CCN(CC4)C)OC)OCCOCCN(C)C.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C27H45N7O3.3C2HF3O2/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;3*3-2(4,5)1(6)7/h19-21H,6-18H2,1-5H3,(H,28,29,30);3*(H,6,7)
InChIKey
FEROTKYRPUJIEB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-(2-(2-(dimethylamino)ethoxy)ethoxy)-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine,tri(trifluoroacetate)salt
CAS: 1934302-25-6
CID: 132285113
Formula: C33H48F9N7O9
MW: 857.8
Interactive 3D Structure
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View on PubChemRaw 3D data

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Alternative Products

CatalogName
B2837-1UNC0321 tri (trifluoroacetate salt)
BA2807-50UNC0321
A13200-100UNC0321 100mg
A13200-25UNC0321 25mg
A13200-50UNC0321 50mg
A13200-5UNC0321 5mg
A13200-1UNC0321 1mg
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