1-(6-Chloro-pyridazin-3-yl)-4-cyclopropyl-perhydro-1,4-diazepine

HCID 87286183
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Basic information

Standard SMILES
Clc1ccc(N2CCCN(C3CC3)CC2)nn1
InChIKey
RTTPQEJMOATJSS-UHFFFAOYSA-N
Molecular formula
C12H17ClN4
Average molar mass
252.74 g/mol

Names & identifiers

Preferred name
1-(6-Chloro-pyridazin-3-yl)-4-cyclopropyl-perhydro-1,4-diazepine
IUPAC
1-(6-chloropyridazin-3-yl)-4-cyclopropyl-1,4-diazepane

Names & synonyms

SCHEMBL1744151RTTPQEJMOATJSS-UHFFFAOYSA-N1-(6-chloro-pyridazin-3-yl)-4-cyclopropyl-perhydro-1,4-diazepine

Database identifiers

PubChem CID
87286183

Properties

Computed structural properties

XLogP
2
Topological polar surface area
32.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
17

Related reactions

2 records
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Compound notes

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