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Home > Indoles and Oxindole > 86979-28-4
86979-28-4 | Pyrimido[1,2-a]indol-10-ol, 2,3,4,10-tetrahydro-3-methyl-10-phenyl-
CAS No: 86979-28-4 Catalog No: AG004KTB MDL No:
Product Description
Catalog Number:
AG004KTB
Chemical Name:
Pyrimido[1,2-a]indol-10-ol, 2,3,4,10-tetrahydro-3-methyl-10-phenyl-
CAS Number:
86979-28-4
Molecular Formula:
C18H18N2O
Molecular Weight:
278.3483
IUPAC Name:
3-methyl-10-phenyl-3,4-dihydro-2H-pyrimido[1,2-a]indol-10-ol
InChI:
InChI=1S/C18H18N2O/c1-13-11-19-17-18(21,14-7-3-2-4-8-14)15-9-5-6-10-16(15)20(17)12-13/h2-10,13,21H,11-12H2,1H3
InChI Key:
VQPGGINSOCTZDA-UHFFFAOYSA-N
SMILES:
CC1CN=C2N(C1)c1ccccc1C2(O)c1ccccc1
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.142g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.355g/mol
Monoisotopic Mass:
278.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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