Home Aminos N-(3-aminopropyl)-6-nitroquinazolin-4-amine dihydrochloride

N-(3-aminopropyl)-6-nitroquinazolin-4-amine dihydrochloride

CAS No.:
1798730-04-7
Catalog Number:
AG01BGHK
Molecular Formula:
C11H15Cl2N5O2
Molecular Weight:
320.1751
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Product Description
Catalog Number:
AG01BGHK
Chemical Name:
N-(3-aminopropyl)-6-nitroquinazolin-4-amine dihydrochloride
CAS Number:
1798730-04-7
Molecular Formula:
C11H15Cl2N5O2
Molecular Weight:
320.1751
MDL Number:
MFCD28125131
IUPAC Name:
N'-(6-nitroquinazolin-4-yl)propane-1,3-diamine;dihydrochloride
InChI:
InChI=1S/C11H13N5O2.2ClH/c12-4-1-5-13-11-9-6-8(16(17)18)2-3-10(9)14-7-15-11;;/h2-3,6-7H,1,4-5,12H2,(H,13,14,15);2*1H
InChI Key:
BYRFDPGUHQMBHA-UHFFFAOYSA-N
SMILES:
NCCCNc1ncnc2c1cc(cc2)[N+](=O)[O-].Cl.Cl
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.06g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
320.174g/mol
Monoisotopic Mass:
319.06g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties