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101195-61-3 | Imidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione, 10,10a-dihydro-2-propyl-
CAS No: 101195-61-3 Catalog No: AG0003WR MDL No:MFCD12076962
Product Description
Catalog Number:
AG0003WR
Chemical Name:
Imidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione, 10,10a-dihydro-2-propyl-
CAS Number:
101195-61-3
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
MDL Number:
MFCD12076962
IUPAC Name:
2-propyl-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione
InChI:
InChI=1S/C14H16N2O2/c1-2-7-15-13(17)12-8-10-5-3-4-6-11(10)9-16(12)14(15)18/h3-6,12H,2,7-9H2,1H3
InChI Key:
WDHCNBWDILCMCF-UHFFFAOYSA-N
SMILES:
CCCN1C(=O)C2N(C1=O)Cc1c(C2)cccc1
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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