Compound C14H16ClN3O2

3-[(4-chlorophenyl)methyl]-4,7,8,9-tetrahydro-2H-pyrazolo[1,2-a][1,2,5]triazepine-1,5-dione

CAS: 86126-25-2

Molecular Formula	`C14H16ClN3O2`
Molecular Weight	293.75 g/mol
LogP	1.5
Topological Polar Surface Area	43.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	293.0931
Heavy Atoms	20
Complexity	372.0

Chemical Identifiers

CAS Number	86126-25-2
SMILES	`C1CN2C(=O)CN(CC(=O)N2C1)CC3=CC=C(C=C3)Cl`
InChIKey	`XWFGGHIYFIBTHQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C14H16ClN3O2 (CAS: 86126-25-2) is a chemical compound with molecular formula C14H16ClN3O2 and molecular weight 293.75 g/mol. Its IUPAC systematic name is 3-[(4-chlorophenyl)methyl]-4,7,8,9-tetrahydro-2H-pyrazolo[1,2-a][1,2,5]triazepine-1,5-dione. LogP 1.5 Topological Polar Surface Area 43.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 293.0931 Heavy Atoms 20 Complexity 372.0 InChI Key: XWFGGHIYFIBTHQ-UHFFFAOYSA-N. SMILES: C1CN2C(=O)CN(CC(=O)N2C1)CC3=CC=C(C=C3)Cl.

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