Name: Name:5-[4-(2,6-dihydroxyphenyl)phenyl]-1H-indole-3-carbonitrile
Brand: Angene
SKU: AG00ILGR
Rating: 90 (10 reviews)

5-[4-(2,6-dihydroxyphenyl)phenyl]-1H-indole-3-carbonitrile

CAS No.:

1179347-65-9

Catalog Number:

AG00ILGR

Molecular Formula:

C21H14N2O2

Molecular Weight:

326.3481

Catalog Number:

AG00ILGR

Chemical Name:

5-[4-(2,6-dihydroxyphenyl)phenyl]-1H-indole-3-carbonitrile

CAS Number:

1179347-65-9

Molecular Formula:

C21H14N2O2

Molecular Weight:

326.3481

IUPAC Name:

5-[4-(2,6-dihydroxyphenyl)phenyl]-1H-indole-3-carbonitrile

InChI:

InChI=1S/C21H14N2O2/c22-11-16-12-23-18-9-8-15(10-17(16)18)13-4-6-14(7-5-13)21-19(24)2-1-3-20(21)25/h1-10,12,23-25H

InChI Key:

IGSYZPLXAFVMKY-UHFFFAOYSA-N

SMILES:

N#Cc1c[nH]c2c1cc(cc2)c1ccc(cc1)c1c(O)cccc1O

Complexity:

497

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

326.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

326.355g/mol

Monoisotopic Mass:

326.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3