Name: Name:11-methyl-13-(3-methylphenyl)-1,8-diazatricyclo[7.4.0.0,2,7]trideca-2,4,6,8,10,12-hexaene-10-carbonitrile
Brand: Angene
SKU: AG019P1E
Rating: 90 (10 reviews)

11-methyl-13-(3-methylphenyl)-1,8-diazatricyclo[7.4.0.0,2,7]trideca-2,4,6,8,10,12-hexaene-10-carbonitrile

CAS No.:

730976-50-8

Catalog Number:

AG019P1E

Molecular Formula:

C20H15N3

Molecular Weight:

297.3532

Catalog Number:

AG019P1E

Chemical Name:

11-methyl-13-(3-methylphenyl)-1,8-diazatricyclo[7.4.0.0,2,7]trideca-2,4,6,8,10,12-hexaene-10-carbonitrile

CAS Number:

730976-50-8

Molecular Formula:

C20H15N3

Molecular Weight:

297.3532

MDL Number:

MFCD04623503

IUPAC Name:

3-methyl-1-(3-methylphenyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

InChI:

InChI=1S/C20H15N3/c1-13-6-5-7-15(10-13)19-11-14(2)16(12-21)20-22-17-8-3-4-9-18(17)23(19)20/h3-11H,1-2H3

InChI Key:

OXANCQIRPXSDBU-UHFFFAOYSA-N

SMILES:

N#Cc1c(C)cc(n2c1nc1c2cccc1)c1cccc(c1)C

Complexity:

481

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

297.361g/mol

Monoisotopic Mass:

297.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.3