AG009C8T

1432660-47-3 | 1-[5-(Cyclopropylsulfamoyl)-2-(thiophen-3-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

AG009C8T

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CAS Number	1432660-47-3
Catalog Number	AG009C8T(AGN-PC-0WNJHD)
Chemical Name	1-[5-(Cyclopropylsulfamoyl)-2-(thiophen-3-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
IUPAC Name	1-[5-(cyclopropylsulfamoyl)-2-thiophen-3-ylphenyl]-3-[3-(trifluoromethyl)phenyl]urea
InChI	InChI=1S/C21H18F3N3O3S2/c22-21(23,24)14-2-1-3-16(10-14)25-20(28)26-19-11-17(32(29,30)27-15-4-5-15)6-7-18(19)13-8-9-31-12-13/h1-3,6-12,15,27H,4-5H2,(H2,25,26,28)
InChI Key	CCAWRGNYALGPQH-UHFFFAOYSA-N
MDL Number	MFCD26097285
Molecular Formula	C21H18F3N3O3S2
Molecular Weight	481.5111
SMILES	O=S(C1=CC=C(C2=CSC=C2)C(NC(NC3=CC=CC(C(F)(F)F)=C3)=O)=C1)(NC4CC4)=O
Synonyms	AGI-6780, AGI-6780, 1432660-47-3, AGI6780, N-cyclopropyl-4-(thiophen-3-yl)-3-(3-(3-(trifluoromethyl)phenyl)ureido)benzenesulfonamide, AGI 6780, AK162157, 1-[5-(Cyclopropylsulfamoyl)-2-Thiophen-3-Yl-Phenyl]-3-[3-(Trifluoromethyl)phenyl]urea, MLS006011046, CHEMBL3392845, SCHEMBL15702521, KS-00000SLO, AOB2268, C21H18F3N3O3S2, DTXSID50744321, EX-A356, QCR-283, HMS3653I21, BCP07383, 2198AH, FD5013, MFCD26097285, s7241, ZINC95803998, AKOS024462890, CS-1556, SB19578, NCGC00347935-01, NCGC00347935-08, 4CA-0127, BC600400, HY-15734, SMR004702838, AB0087819, FT-0764734, SW220033-1, S900006230, 3-(5-(cyclopropylsulfamoyl)-2-(thiophen-3-yl)phenyl)-1-(3-(trifluoromethyl)phenyl)urea, N-Cyclopropyl-3-[3-[3-(trifluoromethyl)phenyl]ureido]-4-(3-thienyl)benzenesulfonamide, 1-[5-(CYCLOPROPYLSULFAMOYL)-2-(THIOPHEN-3-YL)PHENYL]-3-[3-(TRIFLUOROMETHYL)PHENYL]UREA, 1K9, N-Cyclopropyl-4-(thiophen-3-yl)-3-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)benzene-1-sulfonamide, N-Cyclopropyl-4-(thiophen-3-yl)-3-(3-(3-(trifluoromethyl)phenyl)ureido)benzenesulfonamide??, CCAWRGNYALGPQH-UHFFFAOYSA-N, ACN-039838, A3146, A12903, C581155, N-cyclopropyl-4-(3-thienyl)-3-[[[[3-(trifluoromethyl)phenyl]amino]carbonyl]amino]-benzenesulfonamide,

Complexity	771
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	481.074g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	481.508g/mol
Monoisotopic Mass	481.074g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	124A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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