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Home Other Building Blocks 6,7-Dihydro-1-methyl-pyrrolo[2,3-c]azepine-4,8(1h,5h)-dione

6,7-Dihydro-1-methyl-pyrrolo[2,3-c]azepine-4,8(1h,5h)-dione

CAS No.:
150159-13-0
Catalog Number:
AG019EL4
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$252
- +
250mg
95%
In Stock USA
United States
$441
- +
1g
95%
In Stock USA
United States
$882
- +
5g
95%
In Stock USA
United States
$2646
- +
Product Description
Catalog Number:
AG019EL4
Chemical Name:
6,7-Dihydro-1-methyl-pyrrolo[2,3-c]azepine-4,8(1h,5h)-dione
CAS Number:
150159-13-0
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD12964900
IUPAC Name:
1-methyl-6,7-dihydro-5H-pyrrolo[2,3-c]azepine-4,8-dione
InChI:
InChI=1S/C9H10N2O2/c1-11-5-3-6-7(12)2-4-10-9(13)8(6)11/h3,5H,2,4H2,1H3,(H,10,13)
InChI Key:
QCNQUCLPAAQEIX-UHFFFAOYSA-N
SMILES:
O=C1CCNC(=O)c2c1ccn2C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Literature
Title Journal
Synthesis and evaluation of novel anti-proliferative pyrroloazepinone and indoloazepinone oximes derived from the marine natural product hymenialdisine. European journal of medicinal chemistry 20121001
Properties