AG004L42

869640-41-5 | 7-Benzyl-5,6,7,8-tetrahydro-1,7-naphthyridin-2(1H)-one

AG004L42

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CAS Number	869640-41-5
Catalog Number	AG004L42(AGN-PC-0WAC5D)
Chemical Name	7-Benzyl-5,6,7,8-tetrahydro-1,7-naphthyridin-2(1H)-one
IUPAC Name	7-benzyl-1,5,6,8-tetrahydro-1,7-naphthyridin-2-one
InChI	InChI=1S/C15H16N2O/c18-15-7-6-13-8-9-17(11-14(13)16-15)10-12-4-2-1-3-5-12/h1-7H,8-11H2,(H,16,18)
InChI Key	IAXZYZLBSPZMGH-UHFFFAOYSA-N
MDL Number	MFCD11521573
Molecular Formula	C15H16N2O
Molecular Weight	240.3003
SMILES	O=C1NC2=C(CCN(CC3=CC=CC=C3)C2)C=C1
Synonyms	7-Benzyl-5,6,7,8-tetrahydro-1,7-naphthyridin-2(1H)-one, 869640-41-5, AK130020, SCHEMBL3387772, CTK5F7454, DTXSID90722800, IAXZYZLBSPZMGH-UHFFFAOYSA-N, KS-00000P8L, FD7034, MFCD11521573, ZINC90411699, AKOS016014103, CS-W006897, DS-6482, FCH2838335, AJ-128660, AX8219041, 4CH-016468, Y6675, 7-benzyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2(1H)-one, 5,6,7,8-TETRAHYDRO-7-BENZYL-1,7-NAPHTHYRIDIN-2(1H)-ONE, C15H16N2O, 5,6,7,8-TETRAHYDRO-7- -1,7-NAPHTHYRIDIN-2 -ONE,

Complexity	391
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	240.126g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	240.306g/mol
Monoisotopic Mass	240.126g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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