Home Aminos 8-amino-1,4-dimethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-5-one

8-amino-1,4-dimethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-5-one

CAS No.:
1022972-39-9
Catalog Number:
AG01A4HL
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
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Product Description
Catalog Number:
AG01A4HL
Chemical Name:
8-amino-1,4-dimethyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-5-one
CAS Number:
1022972-39-9
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
MDL Number:
MFCD23701880
IUPAC Name:
8-amino-1,4-dimethyl-2,3-dihydro-1,4-benzodiazepin-5-one
InChI:
InChI=1S/C11H15N3O/c1-13-5-6-14(2)11(15)9-4-3-8(12)7-10(9)13/h3-4,7H,5-6,12H2,1-2H3
InChI Key:
OXOROYNDTMBINO-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)N(C)CCN(C2=O)C
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.122g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.261g/mol
Monoisotopic Mass:
205.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties