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88368-28-9 | 7H-Pyrimido[5,4-c]carbazole, 7-ethyl-
CAS No: 88368-28-9 Catalog No: AG004MOX MDL No:
Product Description
Catalog Number:
AG004MOX
Chemical Name:
7H-Pyrimido[5,4-c]carbazole, 7-ethyl-
CAS Number:
88368-28-9
Molecular Formula:
C16H13N3
Molecular Weight:
247.2945
IUPAC Name:
7-ethylpyrimido[5,4-c]carbazole
InChI:
InChI=1S/C16H13N3/c1-2-19-13-6-4-3-5-12(13)15-14(19)8-7-11-9-17-10-18-16(11)15/h3-10H,2H2,1H3
InChI Key:
KTXHCYLQWRCPTI-UHFFFAOYSA-N
SMILES:
CCn1c2ccc3c(c2c2c1cccc2)ncnc3
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.301g/mol
Monoisotopic Mass:
247.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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