AG00CAPK

402948-37-2 | Ethyl 2-[5-(4-methylpiperazinyl)benzimidazol-2-yl]acetate

AG00CAPK

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CAS Number	402948-37-2
Catalog Number	AG00CAPK(AGN-PC-0OA16W)
Chemical Name	Ethyl 2-[5-(4-methylpiperazinyl)benzimidazol-2-yl]acetate
IUPAC Name	ethyl 2-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]acetate
InChI	InChI=1S/C16H22N4O2/c1-3-22-16(21)11-15-17-13-5-4-12(10-14(13)18-15)20-8-6-19(2)7-9-20/h4-5,10H,3,6-9,11H2,1-2H3,(H,17,18)
InChI Key	ANQVKHGDALCPFZ-UHFFFAOYSA-N
MDL Number	MFCD10565679
Molecular Formula	C16H22N4O2
Molecular Weight	302.3715
SMILES	CN1CCN(CC1)C1=CC2=C(N=C(N2)CC(=O)OCC)C=C1
Synonyms	402948-37-2, ethyl 2-(5-(4-methylpiperazin-1-yl)-1H-benzo[d]imidazol-2-yl)acetate, ethyl 2-[5-(4-methylpiperazinyl)benzimidazol-2-yl]acetate, SCHEMBL985935, CTK4I2838, DTXSID40470425, ANQVKHGDALCPFZ-UHFFFAOYSA-N, BCP11304, KS-00000G5W, MFCD10565679, ZINC22012840, AKOS027382649, SB17844, ACM402948372, AK398192, CS-0008237, Ethyl2-[5-(4-methylpiperazinyl)benzimidazol-2-yl]acetate, 5-(4-Methylpiperazino)-1H-benzoimidazole-2-acetic acid ethyl ester, ethyl [5-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]acetate, Ethyl [6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]acetate, [6-(4-Methyl-piperazin-1-yl)-1H-benzimidazol-2-yl]acetic acid ethyl ester, [6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]acetic acid ethyl ester, ETHYL 2-[5-(4-METHYLPIPERAZINYL)BENZO[D]IMIDAZOL-2-YL]ACETATE, [6-(4-Methyl-piperazin-1-yl)-1H-benzimidazol-2-yl]-acetic acid ethyl ester, [6-(4-methyl-piperazin-1-yl)-1H-benzoimidazol-2-yl]-acetic acid ethyl ester, CID11673863, Ethyl 2-[6-(4-methylpiperazin-1-yl)-1H-benzoimidazol-2-yl]acetate,

Complexity	384
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	302.174g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	302.378g/mol
Monoisotopic Mass	302.174g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	61.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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