AG00IXD2

Name: 3-[(3,4-Dimethoxyphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]thiourea
Brand: Angene Chemical
SKU: AG00IXD2

1119391-84-2 | 3-[(3,4-Dimethoxyphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]thiourea

AG00IXD2

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CAS Number	1119391-84-2
Catalog Number	AG00IXD2(AGN-PC-0WB225)
Chemical Name	3-[(3,4-Dimethoxyphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]thiourea
IUPAC Name	1-[(3,4-dimethoxyphenyl)methyl]-3-[4-(trifluoromethoxy)phenyl]thiourea
InChI	InChI=1S/C17H17F3N2O3S/c1-23-14-8-3-11(9-15(14)24-2)10-21-16(26)22-12-4-6-13(7-5-12)25-17(18,19)20/h3-9H,10H2,1-2H3,(H2,21,22,26)
InChI Key	PJHIGKJZFIFTBE-UHFFFAOYSA-N
MDL Number	MFCD01567616
Molecular Formula	C17H17F3N2O3S
Molecular Weight	386.3887
SMILES	S=C(NC1(=CC=C(OC(F)(F)F)C=C1))NCC2(=CC(OC)=C(OC)C=C2)
Synonyms	1119391-84-2, N-(3,4-dimethoxybenzyl)-N'-[4-(trifluoromethoxy)phenyl]thiourea, 3-[(3,4-dimethoxyphenyl)methyl]-1-[4-(trifluoromethoxy)phenyl]thiourea, AC1N67QZ, ZINC2380953, MFCD01567616, AKOS005109676, MCULE-8928591384, MS-7878, KS-000029B7, 1-[(3,4-dimethoxyphenyl)methyl]-3-[4-(trifluoromethoxy)phenyl]thiourea, 1-((3,4-Dimethoxyphenyl)methyl)amino)-3-(4-(trifluoromethoxy)phenyl)thiourea, ZINC02380953, CID4255696,

Complexity	446
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	386.091g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	386.389g/mol
Monoisotopic Mass	386.091g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	83.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited