Home Other Building Blocks 7-methoxy-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one

7-methoxy-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one

CAS No.:
32900-19-9
Catalog Number:
AG01E70J
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
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Product Description
Catalog Number:
AG01E70J
Chemical Name:
7-methoxy-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one
CAS Number:
32900-19-9
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
MDL Number:
MFCD17215456
IUPAC Name:
7-methoxy-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
InChI:
InChI=1S/C10H12N2O2/c1-14-7-2-3-8-9(6-7)11-5-4-10(13)12-8/h2-3,6,11H,4-5H2,1H3,(H,12,13)
InChI Key:
TWKQUQLHTDKRPV-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)NCCC(=O)N2
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties