AG01EOLK

Name: 4-Amino-N-[3-[5-[[4-[(2,6-dichlorophenyl)methyl]-1-piperazinyl]methyl]-3-[4-(trifluoromethoxy)phenyl]-1H-indol-1-yl]propyl]-4-piperidinecarboxamide
Brand: Angene Chemical
SKU: AG01EOLK

1835283-94-7 | 4-Amino-N-[3-[5-[[4-[(2,6-dichlorophenyl)methyl]-1-piperazinyl]methyl]-3-[4-(trifluoromethoxy)phenyl]-1H-indol-1-yl]propyl]-4-piperidinecarboxamide

Chemical structure of 4-Amino-N-[3-[5-[[4-[(2,6-dichlorophenyl)methyl]-1-piperazinyl]methyl]-3-[4-(trifluoromethoxy)phenyl]-1H-indol-1-yl]propyl]-4-piperidinecarboxamide, CAS 1835283-94-7

AG01EOLK

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CAS Number	1835283-94-7
Catalog Number	AG01EOLK(AGN-PC-3H46F9)
Chemical Name	4-Amino-N-[3-[5-[[4-[(2,6-dichlorophenyl)methyl]-1-piperazinyl]methyl]-3-[4-(trifluoromethoxy)phenyl]-1H-indol-1-yl]propyl]-4-piperidinecarboxamide
IUPAC Name	4-amino-N-[3-[5-[[4-[(2,6-dichlorophenyl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indol-1-yl]propyl]piperidine-4-carboxamide
InChI	InChI=1S/C36H41Cl2F3N6O2/c37-31-3-1-4-32(38)30(31)23-46-19-17-45(18-20-46)22-25-5-10-33-28(21-25)29(26-6-8-27(9-7-26)49-36(39,40)41)24-47(33)16-2-13-44-34(48)35(42)11-14-43-15-12-35/h1,3-10,21,24,43H,2,11-20,22-23,42H2,(H,44,48)
InChI Key	GMDFJPPJWWJNKF-UHFFFAOYSA-N
MDL Number	MFCD31382126
Molecular Formula	C36H41Cl2F3N6O2
Molecular Weight	717.6509
SMILES	O=C(NCCCN1C=C(C=2C=CC(OC(F)(F)F)=CC2)C=3C=C(C=CC31)CN4CCN(CC=5C(Cl)=CC=CC5Cl)CC4)C6(N)CCNCC6
Synonyms	Pan-RAS-IN-1, 1835283-94-7, 4-amino-N-(3-(5-((4-(2,6-dichlorobenzyl)piperazin-1-yl)methyl)-3-(4-(trifluoromethoxy)phenyl)-1H-indol-1-yl)propyl)piperidine-4-carboxamide, SCHEMBL17304549, GMDFJPPJWWJNKF-UHFFFAOYSA-N, ZINC669678959, CS-6466, HY-101295,

Complexity	1040
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	716.262g/mol
Formal Charge	0
Heavy Atom Count	49
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	717.659g/mol
Monoisotopic Mass	716.262g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	87.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.8

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited