3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol

C18H14ClNO2 — CID 141045954

IUPAC3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol
SMILESOc1ccc(Cl)cc1C1(O)CNc2c1ccc1ccccc21
InChIInChI=1S/C18H14ClNO2/c19-12-6-8-16(21)15(9-12)18(22)10-20-17-13-4-2-1-3-11(13)5-7-14(17)18/h1-9,20-22H,10H2
InChIKeyXIDGVVFCRDZARS-UHFFFAOYSA-N
MW311.77 g/mol
LogP3.86
Rot. Bonds1

About 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol

3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol (PubChem CID 141045954) has the molecular formula C18H14ClNO2 and a molecular weight of 311.77 g/mol. Its IUPAC name is 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol.

Molecular Properties

Compound Name3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol
PubChem CID141045954
Molecular FormulaC18H14ClNO2
Molecular Weight311.77 g/mol
Exact Mass311.07
IUPAC Name3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol
SMILESOc1ccc(Cl)cc1C1(O)CNc2c1ccc1ccccc21
InChIInChI=1S/C18H14ClNO2/c19-12-6-8-16(21)15(9-12)18(22)10-20-17-13-4-2-1-3-11(13)5-7-14(17)18/h1-9,20-22H,10H2
InChIKeyXIDGVVFCRDZARS-UHFFFAOYSA-N
XLogP3.86
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.77
LogP ≤ 53.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-chloro-2-hydroxyphenyl)-7-(trifluoromethyl)-1,2-dihydroindol-3-ol
CID 140974863
3-(5-chloro-2-hydroxyphenyl)-6-(trifluoromethyl)-1,2-dihydroindol-3-ol
CID 140974859
1-(4-chloro-2-fluorophenyl)naphthalen-2-ol
CID 146212373
3,4-dichloro-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;titanium
CID 88689430
2-chlorobenzo[a]anthracene
CID 23367240
benzene-1,2-diol;4-chlorobenzene-1,2-diol
CID 22153361
2-[1-(aminomethyl)cyclopentyl]-4-chlorophenol
CID 131368937
1-(3-chlorophenyl)sulfanylnaphthalen-2-ol
CID 172795300
3-(5-chloro-2-hydroxyphenyl)-3-hydroxy-6-iodo-1H-indol-2-one
CID 10294489
N-(3-chlorophenyl)-2-hydroxynaphthalene-1-carboxamide
CID 19022893
3-(5-chloro-2-methoxyphenyl)-6-iodo-1,2-dihydroindol-3-ol
CID 141045951
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol?
The IUPAC name of 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol (CID 141045954) is 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol.
What is the SMILES notation for 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol?
The canonical SMILES for 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol is Oc1ccc(Cl)cc1C1(O)CNc2c1ccc1ccccc21.
What is the InChIKey of 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol?
The InChIKey is XIDGVVFCRDZARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO2/c19-12-6-8-16(21)15(9-12)18(22)10-20-17-13-4-2-1-3-11(13)5-7-14(17)18/h1-9,20-22H,10H2.
What are the key properties of 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol?
3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol has a molecular weight of 311.77 g/mol, XLogP of 3.86, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-2-hydroxyphenyl)-1,2-dihydrobenzo[g]indol-3-ol is sourced from PubChem (CID 141045954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).