Home Other Building Blocks 6-(1,4-diazepan-1-yl)-9H-purine trihydrochloride

6-(1,4-diazepan-1-yl)-9H-purine trihydrochloride

CAS No.:
1803596-68-0
Catalog Number:
AG01BDYE
Molecular Formula:
C10H17Cl3N6
Molecular Weight:
327.6412
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BDYE
Chemical Name:
6-(1,4-diazepan-1-yl)-9H-purine trihydrochloride
CAS Number:
1803596-68-0
Molecular Formula:
C10H17Cl3N6
Molecular Weight:
327.6412
MDL Number:
MFCD28063731
IUPAC Name:
6-(1,4-diazepan-1-yl)-7H-purine;trihydrochloride
InChI:
InChI=1S/C10H14N6.3ClH/c1-2-11-3-5-16(4-1)10-8-9(13-6-12-8)14-7-15-10;;;/h6-7,11H,1-5H2,(H,12,13,14,15);3*1H
InChI Key:
NOZDSZSTMVRTQN-UHFFFAOYSA-N
SMILES:
N1CCCN(CC1)c1ncnc2c1nc[nH]2.Cl.Cl.Cl
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.058g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
327.638g/mol
Monoisotopic Mass:
326.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties