200,000+ products from a single source!
sales@angenechem.com
820215-16-5 | 2H-1,4-Benzodiazepin-2-one, 3-amino-1-butyl-1,3-dihydro-5-phenyl-
CAS No: 820215-16-5 Catalog No: AG0053QE MDL No:
Product Description
Catalog Number:
AG0053QE
Chemical Name:
2H-1,4-Benzodiazepin-2-one, 3-amino-1-butyl-1,3-dihydro-5-phenyl-
CAS Number:
820215-16-5
Molecular Formula:
C19H21N3O
Molecular Weight:
307.3895
IUPAC Name:
3-amino-1-butyl-5-phenyl-3H-1,4-benzodiazepin-2-one
InChI:
InChI=1S/C19H21N3O/c1-2-3-13-22-16-12-8-7-11-15(16)17(21-18(20)19(22)23)14-9-5-4-6-10-14/h4-12,18H,2-3,13,20H2,1H3
InChI Key:
TUXWTROPHHIFIL-UHFFFAOYSA-N
SMILES:
CCCCN1C(=O)C(N)N=C(c2c1cccc2)c1ccccc1
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.168g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.397g/mol
Monoisotopic Mass:
307.168g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.