6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole

C24H18F2N2 — CID 132532870

IUPAC6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole
SMILESCc1ccc(C(c2c[nH]c3cc(F)ccc23)c2c[nH]c3cc(F)ccc23)cc1
InChIInChI=1S/C24H18F2N2/c1-14-2-4-15(5-3-14)24(20-12-27-22-10-16(25)6-8-18(20)22)21-13-28-23-11-17(26)7-9-19(21)23/h2-13,24,27-28H,1H3
InChIKeyDNSCKIPQRWTAEP-UHFFFAOYSA-N
MW372.42 g/mol
LogP6.42
Rot. Bonds3

About 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole

6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole (PubChem CID 132532870) has the molecular formula C24H18F2N2 and a molecular weight of 372.42 g/mol. Its IUPAC name is 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole.

Molecular Properties

Compound Name6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole
PubChem CID132532870
Molecular FormulaC24H18F2N2
Molecular Weight372.42 g/mol
Exact Mass372.14
IUPAC Name6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole
SMILESCc1ccc(C(c2c[nH]c3cc(F)ccc23)c2c[nH]c3cc(F)ccc23)cc1
InChIInChI=1S/C24H18F2N2/c1-14-2-4-15(5-3-14)24(20-12-27-22-10-16(25)6-8-18(20)22)21-13-28-23-11-17(26)7-9-19(21)23/h2-13,24,27-28H,1H3
InChIKeyDNSCKIPQRWTAEP-UHFFFAOYSA-N
XLogP6.42
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.42
LogP ≤ 56.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Analyze 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole with MolForge

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Related Compounds

3-[(4-chlorophenyl)-(5-fluoro-1H-indol-3-yl)methyl]-5-fluoro-1H-indole
CID 139526052
ethane;6-fluoro-3-methyl-1H-indole
CID 142460316
3-[1H-indol-3-yl(phenyl)methyl]-5-methyl-1H-indole
CID 25098654
ethyl 2-(6-fluoro-1H-indol-3-yl)-2-hydroxyacetate
CID 115073267
2-(6-fluoro-1H-indol-3-yl)-2-hydroxyacetic acid
CID 115073431
4-(2,4-dimethylphenyl)-2-(6-fluoro-1H-indol-3-yl)-4-oxobutanoic acid
CID 147786619
2-[1H-indol-3-yl-(4-methylphenyl)methyl]-3-methyl-1H-indole
CID 134975119
7-fluoro-3-methyl-1H-quinolin-4-one
CID 175970983
(1S)-1-(6-methyl-1H-indol-3-yl)ethanamine
CID 82759015
methyl 3-(6-fluoro-1H-indol-3-yl)-2,3-dihydroxypropanoate
CID 171865464
(2,4-dimethylphenyl)-(6-fluoro-1H-indol-3-yl)methanone
CID 43163503
(1R)-1-(6-methyl-1H-indol-3-yl)propan-1-ol
CID 82758344

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole?
The IUPAC name of 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole (CID 132532870) is 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole.
What is the SMILES notation for 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole?
The canonical SMILES for 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole is Cc1ccc(C(c2c[nH]c3cc(F)ccc23)c2c[nH]c3cc(F)ccc23)cc1.
What is the InChIKey of 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole?
The InChIKey is DNSCKIPQRWTAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F2N2/c1-14-2-4-15(5-3-14)24(20-12-27-22-10-16(25)6-8-18(20)22)21-13-28-23-11-17(26)7-9-19(21)23/h2-13,24,27-28H,1H3.
What are the key properties of 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole?
6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole has a molecular weight of 372.42 g/mol, XLogP of 6.42, 3 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-[(6-fluoro-1H-indol-3-yl)-(4-methylphenyl)methyl]-1H-indole is sourced from PubChem (CID 132532870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).