(4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone

C19H12ClNO2 — CID 20787891

IUPAC(4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone
SMILESO=C(c1ccc(Cl)cc1)n1c2ccccc2c2ccc(O)cc21
InChIInChI=1S/C19H12ClNO2/c20-13-7-5-12(6-8-13)19(23)21-17-4-2-1-3-15(17)16-10-9-14(22)11-18(16)21/h1-11,22H
InChIKeyAWIQGTBYEOQEFW-UHFFFAOYSA-N
MW321.76 g/mol
LogP4.84
Rot. Bonds1

About (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone

(4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone (PubChem CID 20787891) has the molecular formula C19H12ClNO2 and a molecular weight of 321.76 g/mol. Its IUPAC name is (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone
PubChem CID20787891
Molecular FormulaC19H12ClNO2
Molecular Weight321.76 g/mol
Exact Mass321.06
IUPAC Name(4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone
SMILESO=C(c1ccc(Cl)cc1)n1c2ccccc2c2ccc(O)cc21
InChIInChI=1S/C19H12ClNO2/c20-13-7-5-12(6-8-13)19(23)21-17-4-2-1-3-15(17)16-10-9-14(22)11-18(16)21/h1-11,22H
InChIKeyAWIQGTBYEOQEFW-UHFFFAOYSA-N
XLogP4.84
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.76
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone?
The IUPAC name of (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone (CID 20787891) is (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone.
What is the SMILES notation for (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone?
The canonical SMILES for (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone is O=C(c1ccc(Cl)cc1)n1c2ccccc2c2ccc(O)cc21.
What is the InChIKey of (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone?
The InChIKey is AWIQGTBYEOQEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClNO2/c20-13-7-5-12(6-8-13)19(23)21-17-4-2-1-3-15(17)16-10-9-14(22)11-18(16)21/h1-11,22H.
What are the key properties of (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone?
(4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone has a molecular weight of 321.76 g/mol, XLogP of 4.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(2-hydroxycarbazol-9-yl)methanone is sourced from PubChem (CID 20787891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).