Compound C22H31Cl2N5O3

2,3,5,6-tetramethyl-4-nitro-N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzamide;dihydrochloride

CAS: 104373-53-7

Molecular Formula	`C22H31Cl2N5O3`
Molecular Weight	484.4 g/mol
Topological Polar Surface Area	94.3 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	483.1804
Heavy Atoms	32
Complexity	574.0

Chemical Identifiers

CAS Number	104373-53-7
SMILES	`CC1=C(C(=C(C(=C1C(=O)NCCN2CCN(CC2)C3=CC=CC=N3)C)C)[N+](=O)[O-])C.Cl.Cl`
InChIKey	`KFZIXFYOLXRCFK-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H31Cl2N5O3 (CAS: 104373-53-7) is a chemical compound with molecular formula C22H31Cl2N5O3 and molecular weight 484.4 g/mol. Its IUPAC systematic name is 2,3,5,6-tetramethyl-4-nitro-N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzamide;dihydrochloride. Topological Polar Surface Area 94.3 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 483.1804 Heavy Atoms 32 Complexity 574.0 InChI Key: KFZIXFYOLXRCFK-UHFFFAOYSA-N. SMILES: CC1=C(C(=C(C(=C1C(=O)NCCN2CCN(CC2)C3=CC=CC=N3)C)C)[N+](=O)[O-])C.Cl.Cl.

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