Home Other Building Blocks 5-cyclopropyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one

5-cyclopropyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one

CAS No.:
1461713-59-6
Catalog Number:
AG01A6NT
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
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Product Description
Catalog Number:
AG01A6NT
Chemical Name:
5-cyclopropyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one
CAS Number:
1461713-59-6
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
MDL Number:
MFCD13186108
IUPAC Name:
5-cyclopropyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one
InChI:
InChI=1S/C12H14N2O/c15-12-7-8-14(9-5-6-9)11-4-2-1-3-10(11)13-12/h1-4,9H,5-8H2,(H,13,15)
InChI Key:
DREUVCCPWCNFRY-UHFFFAOYSA-N
SMILES:
O=C1CCN(c2c(N1)cccc2)C1CC1
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties