(3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone

C14H8Cl2N2O2 — CID 166063504

IUPAC(3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone
SMILESO=C(c1cc(Cl)c(O)c(Cl)c1)n1ncc2ccccc21
InChIInChI=1S/C14H8Cl2N2O2/c15-10-5-9(6-11(16)13(10)19)14(20)18-12-4-2-1-3-8(12)7-17-18/h1-7,19H
InChIKeyQBPSRXLNHBRBMD-UHFFFAOYSA-N
MW307.14 g/mol
LogP3.74
Rot. Bonds1

About (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone

(3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone (PubChem CID 166063504) has the molecular formula C14H8Cl2N2O2 and a molecular weight of 307.14 g/mol. Its IUPAC name is (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone.

Molecular Properties

Compound Name(3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone
PubChem CID166063504
Molecular FormulaC14H8Cl2N2O2
Molecular Weight307.14 g/mol
Exact Mass306.00
IUPAC Name(3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone
SMILESO=C(c1cc(Cl)c(O)c(Cl)c1)n1ncc2ccccc21
InChIInChI=1S/C14H8Cl2N2O2/c15-10-5-9(6-11(16)13(10)19)14(20)18-12-4-2-1-3-8(12)7-17-18/h1-7,19H
InChIKeyQBPSRXLNHBRBMD-UHFFFAOYSA-N
XLogP3.74
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3,5-Dichloro-4-hydroxyphenyl)-pyrrolo[3,2-c]pyridin-1-ylmethanone
CID 166063502
(3,5-Dichloro-4-hydroxyphenyl)-(5-methylindazol-1-yl)methanone
CID 166063513
5-chloro-N-[1-(2,6-dichlorobenzoyl)indazol-4-yl]-2-hydroxybenzamide
CID 162656144
US20240150334, Example 26
CID 171469096
N-[[4-(5-chloroindazol-2-yl)cyclohexyl]methyl]-3,5-difluoro-4-hydroxybenzamide
CID 171469215
N-[[4-(5-chloroindazol-2-yl)cyclohexyl]methyl]-2,5-difluoro-4-hydroxybenzamide
CID 171469218
1-(3-Chloro-4-hydroxyphenyl)indazole-5-carboxamide
CID 90281085
1-(3,5-Dichloro-4-hydroxybenzoyl)indole-3-carbonitrile
CID 141459421
(3,5-Dichloro-4-hydroxyphenyl)-(2-methylindol-1-yl)methanone
CID 166063499
(2-Benzylpyrazol-3-yl)-(3-chloro-4-hydroxyphenyl)methanone
CID 174533552
azane;N-[[4-(5-chloroindazol-2-yl)cyclohexyl]methyl]-3,5-difluoro-4-hydroxybenzamide
CID 176032143
3-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-hydroxybenzamide
CID 18277804

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone?
The IUPAC name of (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone (CID 166063504) is (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone.
What is the SMILES notation for (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone?
The canonical SMILES for (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone is O=C(c1cc(Cl)c(O)c(Cl)c1)n1ncc2ccccc21.
What is the InChIKey of (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone?
The InChIKey is QBPSRXLNHBRBMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2O2/c15-10-5-9(6-11(16)13(10)19)14(20)18-12-4-2-1-3-8(12)7-17-18/h1-7,19H.
What are the key properties of (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone?
(3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone has a molecular weight of 307.14 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-4-hydroxyphenyl)-indazol-1-ylmethanone is sourced from PubChem (CID 166063504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).