Compound C13H18Cl2N4O2

3-[(4-hydroxypiperazin-1-yl)methyl]quinazolin-4-one;dihydrochloride

CAS: 68638-38-0

Molecular Formula	`C13H18Cl2N4O2`
Molecular Weight	333.21 g/mol
Topological Polar Surface Area	59.4 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	332.0807
Heavy Atoms	21
Complexity	366.0

Chemical Identifiers

CAS Number	68638-38-0
SMILES	`C1CN(CCN1CN2C=NC3=CC=CC=C3C2=O)O.Cl.Cl`
InChIKey	`ZFUCSHYRYZMOAU-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H18Cl2N4O2 (CAS: 68638-38-0) is a chemical compound with molecular formula C13H18Cl2N4O2 and molecular weight 333.21 g/mol. Its IUPAC systematic name is 3-[(4-hydroxypiperazin-1-yl)methyl]quinazolin-4-one;dihydrochloride. Topological Polar Surface Area 59.4 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 332.0807 Heavy Atoms 21 Complexity 366.0 InChI Key: ZFUCSHYRYZMOAU-UHFFFAOYSA-N. SMILES: C1CN(CCN1CN2C=NC3=CC=CC=C3C2=O)O.Cl.Cl.

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