4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene

C16H10ClFOS — CID 20633779

IUPAC4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene
SMILESC=C1C=C(Sc2ccccc2Cl)c2cc(F)ccc2O1
InChIInChI=1S/C16H10ClFOS/c1-10-8-16(20-15-5-3-2-4-13(15)17)12-9-11(18)6-7-14(12)19-10/h2-9H,1H2
InChIKeyGCPYYYYFIJJZCN-UHFFFAOYSA-N
MW304.77 g/mol
LogP5.52
Rot. Bonds2

About 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene

4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene (PubChem CID 20633779) has the molecular formula C16H10ClFOS and a molecular weight of 304.77 g/mol. Its IUPAC name is 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene.

Molecular Properties

Compound Name4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene
PubChem CID20633779
Molecular FormulaC16H10ClFOS
Molecular Weight304.77 g/mol
Exact Mass304.01
IUPAC Name4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene
SMILESC=C1C=C(Sc2ccccc2Cl)c2cc(F)ccc2O1
InChIInChI=1S/C16H10ClFOS/c1-10-8-16(20-15-5-3-2-4-13(15)17)12-9-11(18)6-7-14(12)19-10/h2-9H,1H2
InChIKeyGCPYYYYFIJJZCN-UHFFFAOYSA-N
XLogP5.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.77
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-Chlorophenyl)sulfonyl-5,8-difluoro-4-methyl-2,3-dihydrochromene
CID 24875617
4-(4-Chlorophenyl)sulfonyl-4-ethyl-5,8-difluoro-2,3-dihydrochromene
CID 24875895
4-(4-Chlorophenyl)sulfanylchromen-2-one
CID 2825279
4-(2-Chloro-4-fluoro-phenyl)sulfanyl-3-(3,5-dimethylphenyl)sulfanyl-chromen-2-one
CID 3013130
4-(2-Chloro-4-fluoro-phenyl)sulfanyl-6-fluoro-chromen-2-one
CID 3013133
4-(2,6-Dichlorophenyl)sulfanyl-6-fluoro-chromen-2-one
CID 3013125
4-(2,5-Dichlorophenyl)sulfanyl-6-fluoro-chromen-2-one
CID 3013135
4-(2-Chlorophenyl)sulfanyl-6-fluoro-chromen-2-one
CID 3013136
(Z)-(5-(4-(benzyloxy)phenyl)-1,1-difluoropent-2-en-2-yl)(4-chlorophenyl)sulfane
CID 162623314
4-(2,4-Difluorophenyl)sulfanyl-6-fluoro-2-methylidenechromene
CID 20633775
4-(2,5-Dichlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene
CID 20633776
4-(2-Chloro-4-fluorophenyl)sulfanyl-6-fluoro-2-methylidenechromene
CID 20633778

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene?
The IUPAC name of 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene (CID 20633779) is 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene.
What is the SMILES notation for 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene?
The canonical SMILES for 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene is C=C1C=C(Sc2ccccc2Cl)c2cc(F)ccc2O1.
What is the InChIKey of 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene?
The InChIKey is GCPYYYYFIJJZCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClFOS/c1-10-8-16(20-15-5-3-2-4-13(15)17)12-9-11(18)6-7-14(12)19-10/h2-9H,1H2.
What are the key properties of 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene?
4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene has a molecular weight of 304.77 g/mol, XLogP of 5.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)sulfanyl-6-fluoro-2-methylidenechromene is sourced from PubChem (CID 20633779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).