200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1252650-37-5
1252650-37-5 | Pyrazino[1,2-a][1,5]benzodiazepin-6(7H)-one, 1,2,3,4,4a,5-hexahydro-10-methyl-
CAS No: 1252650-37-5 Catalog No: AG000NEM MDL No:
Product Description
Catalog Number:
AG000NEM
Chemical Name:
Pyrazino[1,2-a][1,5]benzodiazepin-6(7H)-one, 1,2,3,4,4a,5-hexahydro-10-methyl-
CAS Number:
1252650-37-5
Molecular Formula:
C13H17N3O
Molecular Weight:
231.2936
IUPAC Name:
10-methyl-2,3,4,4a,5,7-hexahydro-1H-pyrazino[1,2-a][1,5]benzodiazepin-6-one
InChI:
InChI=1S/C13H17N3O/c1-9-2-3-11-12(6-9)16-5-4-14-8-10(16)7-13(17)15-11/h2-3,6,10,14H,4-5,7-8H2,1H3,(H,15,17)
InChI Key:
CQWBTNMXUFIACV-UHFFFAOYSA-N
SMILES:
O=C1CC2CNCCN2c2c(N1)ccc(c2)C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.137g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.299g/mol
Monoisotopic Mass:
231.137g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.