Compound C16H20N6

2-methyl-5-(4-methylpiperazin-1-yl)-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepine

CAS: 95634-82-5

Molecular Formula	`C16H20N6`
Molecular Weight	296.37 g/mol
LogP	1.8
Topological Polar Surface Area	49.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	296.17496
Heavy Atoms	22
Complexity	430.0

Chemical Identifiers

CAS Number	95634-82-5
SMILES	`CC1=NN2C(=N1)CC3=CC=CC=C3N=C2N4CCN(CC4)C`
InChIKey	`PUHMYHQVPODHCZ-UHFFFAOYSA-N`

📖 Product Overview

Compound C16H20N6 (CAS: 95634-82-5) is a chemical compound with molecular formula C16H20N6 and molecular weight 296.37 g/mol. Its IUPAC systematic name is 2-methyl-5-(4-methylpiperazin-1-yl)-11H-[1,2,4]triazolo[1,5-c][1,3]benzodiazepine. LogP 1.8 Topological Polar Surface Area 49.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 296.17496 Heavy Atoms 22 Complexity 430.0 InChI Key: PUHMYHQVPODHCZ-UHFFFAOYSA-N. SMILES: CC1=NN2C(=N1)CC3=CC=CC=C3N=C2N4CCN(CC4)C.

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