7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol

C16H10ClNO3 — CID 135466468

IUPAC7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol
SMILESOc1ccc2c(c1)OCc1c-2nc2ccc(O)cc2c1Cl
InChIInChI=1S/C16H10ClNO3/c17-15-11-5-8(19)2-4-13(11)18-16-10-3-1-9(20)6-14(10)21-7-12(15)16/h1-6,19-20H,7H2
InChIKeyRYBHKLZSHRZGQK-UHFFFAOYSA-N
MW299.71 g/mol
LogP3.86
Rot. Bonds

About 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol

7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol (PubChem CID 135466468) has the molecular formula C16H10ClNO3 and a molecular weight of 299.71 g/mol. Its IUPAC name is 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol.

Molecular Properties

Compound Name7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol
PubChem CID135466468
Molecular FormulaC16H10ClNO3
Molecular Weight299.71 g/mol
Exact Mass299.03
IUPAC Name7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol
SMILESOc1ccc2c(c1)OCc1c-2nc2ccc(O)cc2c1Cl
InChIInChI=1S/C16H10ClNO3/c17-15-11-5-8(19)2-4-13(11)18-16-10-3-1-9(20)6-14(10)21-7-12(15)16/h1-6,19-20H,7H2
InChIKeyRYBHKLZSHRZGQK-UHFFFAOYSA-N
XLogP3.86
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.71
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol?
The IUPAC name of 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol (CID 135466468) is 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol.
What is the SMILES notation for 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol?
The canonical SMILES for 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol is Oc1ccc2c(c1)OCc1c-2nc2ccc(O)cc2c1Cl.
What is the InChIKey of 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol?
The InChIKey is RYBHKLZSHRZGQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClNO3/c17-15-11-5-8(19)2-4-13(11)18-16-10-3-1-9(20)6-14(10)21-7-12(15)16/h1-6,19-20H,7H2.
What are the key properties of 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol?
7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol has a molecular weight of 299.71 g/mol, XLogP of 3.86, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol is sourced from PubChem (CID 135466468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).